methyl ({2-[(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)amino]-2-oxoethyl}sulfanyl)acetate
Chemical Structure Depiction of
methyl ({2-[(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)amino]-2-oxoethyl}sulfanyl)acetate
methyl ({2-[(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)amino]-2-oxoethyl}sulfanyl)acetate
Compound characteristics
Compound ID: | 8249-2790 |
Compound Name: | methyl ({2-[(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)amino]-2-oxoethyl}sulfanyl)acetate |
Molecular Weight: | 337.4 |
Molecular Formula: | C15 H19 N3 O4 S |
Smiles: | CC1(C)CC(c2cnc(NC(CSCC(=O)OC)=O)nc2C1)=O |
Stereo: | ACHIRAL |
logP: | 1.135 |
logD: | 1.0235 |
logSw: | -2.2158 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.863 |
InChI Key: | KXONWQMYIJRNBN-UHFFFAOYSA-N |