2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide
Chemical Structure Depiction of
2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide
2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide
Compound characteristics
Compound ID: | E140-0001 |
Compound Name: | 2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide |
Molecular Weight: | 406.51 |
Molecular Formula: | C22 H22 N4 O2 S |
Smiles: | C1CN(CC2=C1N=C(NC2=O)SCC(Nc1ccccc1)=O)Cc1ccccc1 |
Stereo: | ACHIRAL |
logP: | 2.3415 |
logD: | 1.7921 |
logSw: | -2.7151 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 61.095 |
InChI Key: | LQOCPNPNNLWDDN-UHFFFAOYSA-N |