N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0148 |
| Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 502.64 |
| Molecular Formula: | C28 H30 N4 O3 S |
| Smiles: | COc1ccc(cc1)N1CCN(CCCNC(c2ccc3c(c2)NC(c2ccccc2S3)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.0959 |
| logD: | 3.5521 |
| logSw: | -4.0635 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.217 |
| InChI Key: | ZFEDKRXVIPXVAC-UHFFFAOYSA-N |