10-[(3-fluorophenyl)methyl]-11-oxo-N-{3-[(propan-2-yl)oxy]propyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(3-fluorophenyl)methyl]-11-oxo-N-{3-[(propan-2-yl)oxy]propyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-fluorophenyl)methyl]-11-oxo-N-{3-[(propan-2-yl)oxy]propyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-4579 |
| Compound Name: | 10-[(3-fluorophenyl)methyl]-11-oxo-N-{3-[(propan-2-yl)oxy]propyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C27 H27 F N2 O3 S |
| Smiles: | CC(C)OCCCNC(c1ccc2c(c1)N(Cc1cccc(c1)F)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1327 |
| logD: | 5.1327 |
| logSw: | -4.7648 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.128 |
| InChI Key: | WJVCDJQSUCHUEC-UHFFFAOYSA-N |