N-(2-nitrophenyl)-2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-nitrophenyl)-2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
N-(2-nitrophenyl)-2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8010-1898 |
| Compound Name: | N-(2-nitrophenyl)-2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 478.55 |
| Molecular Formula: | C23 H18 N4 O4 S2 |
| Smiles: | C1Cc2c3C(N(C(=Nc3sc2C1)SCC(Nc1ccccc1[N+]([O-])=O)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2369 |
| logD: | 4.231 |
| logSw: | -4.4914 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.881 |
| InChI Key: | QEYHRQQMGYCWMY-UHFFFAOYSA-N |