2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | G681-0827 |
| Compound Name: | 2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide |
| Molecular Weight: | 451.95 |
| Molecular Formula: | C24 H19 Cl F N3 O S |
| Smiles: | C1C(c2ccc(cc2)[Cl])=Nc2ccccc2N=C1SCC(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9798 |
| logD: | 4.9651 |
| logSw: | -5.2888 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.661 |
| InChI Key: | KNOBKOVPOWYHIB-UHFFFAOYSA-N |