N-(3,4-dimethylphenyl)-2-[5-(4-fluorophenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-[5-(4-fluorophenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]acetamide
N-(3,4-dimethylphenyl)-2-[5-(4-fluorophenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]acetamide
Compound characteristics
| Compound ID: | G375-2554 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-[5-(4-fluorophenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]acetamide |
| Molecular Weight: | 475.58 |
| Molecular Formula: | C27 H26 F N3 O2 S |
| Smiles: | Cc1ccc(cc1C)NC(CN1C(CN=C(c2ccc(cc2)F)c2c3CCCCc3sc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7189 |
| logD: | 5.7189 |
| logSw: | -5.4046 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.463 |
| InChI Key: | DBMQXNBEIVYBTB-UHFFFAOYSA-N |