2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | E140-0037 |
| Compound Name: | 2-[(6-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 452.6 |
| Molecular Formula: | C23 H24 N4 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CSC1NC(C2CN(CCC=2N=1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9941 |
| logD: | 2.4447 |
| logSw: | -3.5073 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.095 |
| InChI Key: | RJJBYAVBNXVMAG-UHFFFAOYSA-N |