1,4,11-trimethyl-N-(4-phenylbutan-2-yl)dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
1,4,11-trimethyl-N-(4-phenylbutan-2-yl)dibenzo[b,f][1,4]thiazepine-8-carboxamide
1,4,11-trimethyl-N-(4-phenylbutan-2-yl)dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C700-0916 |
| Compound Name: | 1,4,11-trimethyl-N-(4-phenylbutan-2-yl)dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 428.6 |
| Molecular Formula: | C27 H28 N2 O S |
| Smiles: | CC(CCc1ccccc1)NC(c1ccc2c(c1)N=C(C)c1c(C)ccc(C)c1S2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0824 |
| logD: | 6.082 |
| logSw: | -5.4834 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.355 |
| InChI Key: | SHCDBTUTPWGZOU-IBGZPJMESA-N |