N-{2-[cyclohexyl(methyl)amino]ethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-{2-[cyclohexyl(methyl)amino]ethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-{2-[cyclohexyl(methyl)amino]ethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0084 |
| Compound Name: | N-{2-[cyclohexyl(methyl)amino]ethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C23 H27 N3 O2 S |
| Smiles: | CN(CCNC(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.9868 |
| logD: | 3.051 |
| logSw: | -4.0545 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.468 |
| InChI Key: | PBNBCZRBLOEQFX-UHFFFAOYSA-N |