N-(2,2-dimethoxyethyl)-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-(2,2-dimethoxyethyl)-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-(2,2-dimethoxyethyl)-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-0695 |
| Compound Name: | N-(2,2-dimethoxyethyl)-11-ethyl-N,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 398.52 |
| Molecular Formula: | C22 H26 N2 O3 S |
| Smiles: | CCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(N(C)CC(OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.538 |
| logD: | 3.5362 |
| logSw: | -3.7858 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.147 |
| InChI Key: | DTZYLHLYTAGFCK-UHFFFAOYSA-N |