methyl N-({[7-acetyl-3-(2-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)glycinate
Chemical Structure Depiction of
methyl N-({[7-acetyl-3-(2-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)glycinate
methyl N-({[7-acetyl-3-(2-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)glycinate
Compound characteristics
| Compound ID: | G641-0185 |
| Compound Name: | methyl N-({[7-acetyl-3-(2-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)glycinate |
| Molecular Weight: | 500.59 |
| Molecular Formula: | C23 H24 N4 O5 S2 |
| Smiles: | CC(N1CCc2c3C(N(C(=Nc3sc2C1)SCC(NCC(=O)OC)=O)c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.914 |
| logD: | 1.914 |
| logSw: | -2.3379 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.132 |
| InChI Key: | VHWGAYJRWLTNKK-UHFFFAOYSA-N |