N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-4768 |
| Compound Name: | N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 526.74 |
| Molecular Formula: | C32 H38 N4 O S |
| Smiles: | CCCC1c2ccccc2Sc2ccc(cc2N=1)C(NCCCN1CCN(CC1)c1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6249 |
| logD: | 5.4784 |
| logSw: | -5.5099 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.427 |
| InChI Key: | DILLSHSXBIBZPD-UHFFFAOYSA-N |