10-[(3-chlorophenyl)methyl]-N-[3-(diethylamino)-2-methylpropyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(3-chlorophenyl)methyl]-N-[3-(diethylamino)-2-methylpropyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-chlorophenyl)methyl]-N-[3-(diethylamino)-2-methylpropyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-3617 |
| Compound Name: | 10-[(3-chlorophenyl)methyl]-N-[3-(diethylamino)-2-methylpropyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 522.11 |
| Molecular Formula: | C29 H32 Cl N3 O2 S |
| Smiles: | CCN(CC)CC(C)CNC(c1ccc2c(c1)N(Cc1cccc(c1)[Cl])C(c1ccccc1S2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3192 |
| logD: | 3.5795 |
| logSw: | -5.9745 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.518 |
| InChI Key: | XOGTYJRIGWQPBN-FQEVSTJZSA-N |