N-[2-(4-ethylpiperazin-1-yl)ethyl]-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[2-(4-ethylpiperazin-1-yl)ethyl]-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[2-(4-ethylpiperazin-1-yl)ethyl]-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-0419 |
| Compound Name: | N-[2-(4-ethylpiperazin-1-yl)ethyl]-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 436.62 |
| Molecular Formula: | C25 H32 N4 O S |
| Smiles: | CCCC1c2ccccc2Sc2ccc(cc2N=1)C(NCCN1CCN(CC)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8713 |
| logD: | 3.0787 |
| logSw: | -3.8901 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.005 |
| InChI Key: | LEHBGPLCLFIUTK-UHFFFAOYSA-N |