ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA BARU TURUNAN SULFENIL METILKARBAMAT DENGAN METODE SEMIEMPIRIK AM1
QSAR (Quantitative Structure Activity Relationship) analysis of insecticide compounds of sulfenyl methylcarbamate derivatives has been investigated. Acivities of sulfenyl methylcarbamate derivatives has been obtained from the literature. Calculations of descriptors and structural modeling of sulfeny...
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| Format: | Thesis |
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[Yogyakarta] : Universitas Gadjah Mada
2012
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| _version_ | 1826045690428522496 |
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| author | , RINI SELLY , Dr. Dwi Siswanta, M.Eng., |
| author_facet | , RINI SELLY , Dr. Dwi Siswanta, M.Eng., |
| author_sort | , RINI SELLY |
| collection | UGM |
| description | QSAR (Quantitative Structure Activity Relationship) analysis of
insecticide compounds of sulfenyl methylcarbamate derivatives has been
investigated. Acivities of sulfenyl methylcarbamate derivatives has been obtained
from the literature. Calculations of descriptors and structural modeling of sulfenyl
methylcarbamate derivative have been done by Austin Model 1 (AM1) method.
QSAR analysis was performed by multiple linier regression (MLR) and principal
componen regression (PCR) analysis methods to get the best QSAR model for
predicting housefly insecticide activity. The best model is:
Log LD50= 2, 675 � 50,476 qC6 � 0,183 dipole + 0,001 SA
n = 19, R = 0,889, SE = 0,174 Fcal/Ftab = 5,743, PRESS = 0,452
Based on the above model, a new insecticide compound of sulfenyl
methylcarbamate derivatives namely 2,2-dimethyl-2,3-dihydrobenzofuran-7-yl-2-
hidroxyetilthio (methyl) carbamat has been designed with higher housefly
insecticide activity. |
| first_indexed | 2024-03-13T22:41:16Z |
| format | Thesis |
| id | oai:generic.eprints.org:100065 |
| institution | Universiti Gadjah Mada |
| last_indexed | 2024-03-13T22:41:16Z |
| publishDate | 2012 |
| publisher | [Yogyakarta] : Universitas Gadjah Mada |
| record_format | dspace |
| spelling | oai:generic.eprints.org:1000652016-03-04T08:48:24Z https://repository.ugm.ac.id/100065/ ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA BARU TURUNAN SULFENIL METILKARBAMAT DENGAN METODE SEMIEMPIRIK AM1 , RINI SELLY , Dr. Dwi Siswanta, M.Eng., ETD QSAR (Quantitative Structure Activity Relationship) analysis of insecticide compounds of sulfenyl methylcarbamate derivatives has been investigated. Acivities of sulfenyl methylcarbamate derivatives has been obtained from the literature. Calculations of descriptors and structural modeling of sulfenyl methylcarbamate derivative have been done by Austin Model 1 (AM1) method. QSAR analysis was performed by multiple linier regression (MLR) and principal componen regression (PCR) analysis methods to get the best QSAR model for predicting housefly insecticide activity. The best model is: Log LD50= 2, 675 � 50,476 qC6 � 0,183 dipole + 0,001 SA n = 19, R = 0,889, SE = 0,174 Fcal/Ftab = 5,743, PRESS = 0,452 Based on the above model, a new insecticide compound of sulfenyl methylcarbamate derivatives namely 2,2-dimethyl-2,3-dihydrobenzofuran-7-yl-2- hidroxyetilthio (methyl) carbamat has been designed with higher housefly insecticide activity. [Yogyakarta] : Universitas Gadjah Mada 2012 Thesis NonPeerReviewed , RINI SELLY and , Dr. Dwi Siswanta, M.Eng., (2012) ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA BARU TURUNAN SULFENIL METILKARBAMAT DENGAN METODE SEMIEMPIRIK AM1. UNSPECIFIED thesis, UNSPECIFIED. http://etd.ugm.ac.id/index.php?mod=penelitian_detail&sub=PenelitianDetail&act=view&typ=html&buku_id=56896 |
| spellingShingle | ETD , RINI SELLY , Dr. Dwi Siswanta, M.Eng., ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA BARU TURUNAN SULFENIL METILKARBAMAT DENGAN METODE SEMIEMPIRIK AM1 |
| title | ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA
BARU TURUNAN SULFENIL METILKARBAMAT DENGAN
METODE SEMIEMPIRIK AM1 |
| title_full | ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA
BARU TURUNAN SULFENIL METILKARBAMAT DENGAN
METODE SEMIEMPIRIK AM1 |
| title_fullStr | ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA
BARU TURUNAN SULFENIL METILKARBAMAT DENGAN
METODE SEMIEMPIRIK AM1 |
| title_full_unstemmed | ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA
BARU TURUNAN SULFENIL METILKARBAMAT DENGAN
METODE SEMIEMPIRIK AM1 |
| title_short | ANALISIS HKSA INSEKTISIDA DAN DESAIN SENYAWA
BARU TURUNAN SULFENIL METILKARBAMAT DENGAN
METODE SEMIEMPIRIK AM1 |
| title_sort | analisis hksa insektisida dan desain senyawa baru turunan sulfenil metilkarbamat dengan metode semiempirik am1 |
| topic | ETD |
| work_keys_str_mv | AT riniselly analisishksainsektisidadandesainsenyawabaruturunansulfenilmetilkarbamatdenganmetodesemiempirikam1 AT drdwisiswantameng analisishksainsektisidadandesainsenyawabaruturunansulfenilmetilkarbamatdenganmetodesemiempirikam1 |