10-[(2,5-dimethylphenyl)methyl]-N-[3-(2-methylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(2,5-dimethylphenyl)methyl]-N-[3-(2-methylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(2,5-dimethylphenyl)methyl]-N-[3-(2-methylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-1210 |
| Compound Name: | 10-[(2,5-dimethylphenyl)methyl]-N-[3-(2-methylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 527.73 |
| Molecular Formula: | C32 H37 N3 O2 S |
| Smiles: | CC1CCCCN1CCCNC(c1ccc2c(c1)N(Cc1cc(C)ccc1C)C(c1ccccc1S2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3459 |
| logD: | 3.4975 |
| logSw: | -5.3781 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.089 |
| InChI Key: | CQXZTYPCFQXTCM-DEOSSOPVSA-N |