2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide
Chemical Structure Depiction of
2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide
2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide
Compound characteristics
| Compound ID: | K263-0750 |
| Compound Name: | 2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide |
| Molecular Weight: | 532.08 |
| Molecular Formula: | C28 H22 Cl N3 O2 S2 |
| Smiles: | C=CCN(C(CSC1=Nc2c3ccccc3sc2C(N1Cc1ccccc1[Cl])=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5422 |
| logD: | 6.5422 |
| logSw: | -6.2331 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.611 |
| InChI Key: | FZGGTNUQDDYZGL-UHFFFAOYSA-N |