N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(thiophen-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(thiophen-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(thiophen-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C201-1445 |
| Compound Name: | N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(thiophen-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 493.96 |
| Molecular Formula: | C22 H15 Cl F3 N3 O S2 |
| Smiles: | C1C(c2cccs2)=Nc2ccccc2N=C1SCC(Nc1ccc(cc1C(F)(F)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8163 |
| logD: | 5.8157 |
| logSw: | -5.9495 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.66 |
| InChI Key: | OUULWCKFVGOQPV-UHFFFAOYSA-N |