3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(thiophen-2-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(thiophen-2-yl)prop-2-en-1-one
3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(thiophen-2-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | D009-0580 |
| Compound Name: | 3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(thiophen-2-yl)prop-2-en-1-one |
| Molecular Weight: | 396.55 |
| Molecular Formula: | C23 H28 N2 O2 S |
| Smiles: | CCCCN(C)CC(Cn1cc(/C=C/C(c2cccs2)=O)c2ccccc12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4266 |
| logD: | 3.1753 |
| logSw: | -3.9011 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.95 |
| InChI Key: | SALBKFMJBBCCIC-IBGZPJMESA-N |