10-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-ethylpiperidin-1-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-ethylpiperidin-1-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-ethylpiperidin-1-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-7106 |
| Compound Name: | 10-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-ethylpiperidin-1-yl)ethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 552.11 |
| Molecular Formula: | C30 H31 Cl F N3 O2 S |
| Smiles: | CCC1CCCCN1CCNC(c1ccc2c(c1)N(Cc1ccc(cc1[Cl])F)C(c1ccccc1S2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3682 |
| logD: | 5.1179 |
| logSw: | -6.0053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.45 |
| InChI Key: | FBJSPDULSNATLP-QHCPKHFHSA-N |