N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K784-7507 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 527.73 |
| Molecular Formula: | C32 H37 N3 O2 S |
| Smiles: | CC1CC(C)CN(CCCNC(c2ccc3c(c2)N(Cc2ccc(C)cc2)C(c2ccccc2S3)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4097 |
| logD: | 3.8627 |
| logSw: | -5.4316 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.505 |
| InChI Key: | DSQMYDWGVLZLFI-UHFFFAOYSA-N |