10-[(2-chloro-6-fluorophenyl)methyl]-N,N-bis(2-methylpropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(2-chloro-6-fluorophenyl)methyl]-N,N-bis(2-methylpropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(2-chloro-6-fluorophenyl)methyl]-N,N-bis(2-methylpropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C380-0608 |
| Compound Name: | 10-[(2-chloro-6-fluorophenyl)methyl]-N,N-bis(2-methylpropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 525.09 |
| Molecular Formula: | C29 H30 Cl F N2 O2 S |
| Smiles: | CC(C)CN(CC(C)C)C(c1ccc2c(c1)N(Cc1c(cccc1[Cl])F)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3253 |
| logD: | 7.3253 |
| logSw: | -6.2102 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.883 |
| InChI Key: | KEFIZIMTQSFDGR-UHFFFAOYSA-N |