10-[(3-chlorophenyl)methyl]-N-[3-(morpholin-4-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(3-chlorophenyl)methyl]-N-[3-(morpholin-4-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-chlorophenyl)methyl]-N-[3-(morpholin-4-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-3635 |
| Compound Name: | 10-[(3-chlorophenyl)methyl]-N-[3-(morpholin-4-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 522.07 |
| Molecular Formula: | C28 H28 Cl N3 O3 S |
| Smiles: | C(CNC(c1ccc2c(c1)N(Cc1cccc(c1)[Cl])C(c1ccccc1S2)=O)=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.6952 |
| logD: | 4.307 |
| logSw: | -4.7602 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.547 |
| InChI Key: | REPBTXGEXRPQIT-UHFFFAOYSA-N |