2-({7-acetyl-3-[(furan-2-yl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-({7-acetyl-3-[(furan-2-yl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
2-({7-acetyl-3-[(furan-2-yl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | G641-0372 |
| Compound Name: | 2-({7-acetyl-3-[(furan-2-yl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 536.67 |
| Molecular Formula: | C27 H28 N4 O4 S2 |
| Smiles: | CC(C)c1ccc(cc1)NC(CSC1=Nc2c(C(N1Cc1ccco1)=O)c1CCN(Cc1s2)C(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5722 |
| logD: | 4.5722 |
| logSw: | -4.3393 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.621 |
| InChI Key: | PXIYVZGYGZPDJD-UHFFFAOYSA-N |