methyl N-{[(7-acetyl-4-oxo-3-phenyl-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-4-oxo-3-phenyl-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-4-oxo-3-phenyl-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: | G641-0051 |
| Compound Name: | methyl N-{[(7-acetyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}glycinate |
| Molecular Weight: | 486.57 |
| Molecular Formula: | C22 H22 N4 O5 S2 |
| Smiles: | CC(N1CCc2c3C(N(C(=Nc3sc2C1)SCC(NCC(=O)OC)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3644 |
| logD: | 1.3644 |
| logSw: | -2.2636 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.433 |
| InChI Key: | NFHFLEGZLDMEJX-UHFFFAOYSA-N |