N-benzyl-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-benzyl-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-benzyl-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-1273 |
| Compound Name: | N-benzyl-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C25 H24 N2 O S |
| Smiles: | CCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(N(C)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7108 |
| logD: | 5.7091 |
| logSw: | -5.3633 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.3811 |
| InChI Key: | FXHJLZOEHPJEHE-UHFFFAOYSA-N |