N-{2-[(butan-2-yl)(cyclohexyl)amino]ethyl}-11-ethyl-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-{2-[(butan-2-yl)(cyclohexyl)amino]ethyl}-11-ethyl-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-{2-[(butan-2-yl)(cyclohexyl)amino]ethyl}-11-ethyl-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-3749 |
| Compound Name: | N-{2-[(butan-2-yl)(cyclohexyl)amino]ethyl}-11-ethyl-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 477.71 |
| Molecular Formula: | C29 H39 N3 O S |
| Smiles: | CCC(C)N(CCNC(c1ccc2c(c1)N=C(CC)c1cc(C)ccc1S2)=O)C1CCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.1462 |
| logD: | 5.7127 |
| logSw: | -5.4012 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.912 |
| InChI Key: | MURFXZWJYJHFFG-NRFANRHFSA-N |