3-{1-[2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-1H-indol-3-yl}-1-(thiophen-2-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-{1-[2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-1H-indol-3-yl}-1-(thiophen-2-yl)prop-2-en-1-one
3-{1-[2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-1H-indol-3-yl}-1-(thiophen-2-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | D009-0585 |
| Compound Name: | 3-{1-[2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-1H-indol-3-yl}-1-(thiophen-2-yl)prop-2-en-1-one |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C23 H27 N3 O2 S |
| Smiles: | CN1CCN(CC1)CC(Cn1cc(/C=C/C(c2cccs2)=O)c2ccccc12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7946 |
| logD: | 1.7694 |
| logSw: | -2.8654 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.064 |
| InChI Key: | NLFSPQOLYNNZJB-LJQANCHMSA-N |