11-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
11-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
11-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0120 |
| Compound Name: | 11-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C24 H30 N4 O2 S |
| Smiles: | CCCN1CCN(CCCNC(c2ccc3c(c2)NC(c2ccccc2S3)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.987 |
| logD: | 2.0222 |
| logSw: | -3.5369 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.203 |
| InChI Key: | LKJBAPGLAIJNQO-UHFFFAOYSA-N |