11-ethyl-2-methyl-N-{3-[(propan-2-yl)oxy]propyl}dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
11-ethyl-2-methyl-N-{3-[(propan-2-yl)oxy]propyl}dibenzo[b,f][1,4]thiazepine-8-carboxamide
11-ethyl-2-methyl-N-{3-[(propan-2-yl)oxy]propyl}dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-0517 |
| Compound Name: | 11-ethyl-2-methyl-N-{3-[(propan-2-yl)oxy]propyl}dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 396.55 |
| Molecular Formula: | C23 H28 N2 O2 S |
| Smiles: | CCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(NCCCOC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7379 |
| logD: | 4.7375 |
| logSw: | -4.3944 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.958 |
| InChI Key: | QWKYGHLJVVYQQX-UHFFFAOYSA-N |