10-[(4-chlorophenyl)methyl]-N-cyclooctyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(4-chlorophenyl)methyl]-N-cyclooctyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(4-chlorophenyl)methyl]-N-cyclooctyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-3492 |
| Compound Name: | 10-[(4-chlorophenyl)methyl]-N-cyclooctyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 505.08 |
| Molecular Formula: | C29 H29 Cl N2 O2 S |
| Smiles: | C1CCCC(CCC1)NC(c1ccc2c(c1)N(Cc1ccc(cc1)[Cl])C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7635 |
| logD: | 7.7635 |
| logSw: | -6.5468 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.87 |
| InChI Key: | RTIGGCZASFGXFW-UHFFFAOYSA-N |