N-[(2-chlorophenyl)methyl]-2-(11-oxodibenzo[b,f][1,4]thiazepin-10(11H)-yl)acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-(11-oxodibenzo[b,f][1,4]thiazepin-10(11H)-yl)acetamide
N-[(2-chlorophenyl)methyl]-2-(11-oxodibenzo[b,f][1,4]thiazepin-10(11H)-yl)acetamide
Compound characteristics
| Compound ID: | C795-0450 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-(11-oxodibenzo[b,f][1,4]thiazepin-10(11H)-yl)acetamide |
| Molecular Weight: | 408.9 |
| Molecular Formula: | C22 H17 Cl N2 O2 S |
| Smiles: | C(c1ccccc1[Cl])NC(CN1C(c2ccccc2Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0154 |
| logD: | 5.0154 |
| logSw: | -5.0146 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.872 |
| InChI Key: | FNWCPNMLWAXCAT-UHFFFAOYSA-N |