3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one
Chemical Structure Depiction of
3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one
3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one
Compound characteristics
| Compound ID: | D009-0562 |
| Compound Name: | 3-(1-{3-[butyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one |
| Molecular Weight: | 434.58 |
| Molecular Formula: | C27 H34 N2 O3 |
| Smiles: | CCCCN(C)CC(Cn1cc(/C=C/C(c2ccc(cc2)OCC)=O)c2ccccc12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7592 |
| logD: | 3.5078 |
| logSw: | -4.249 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.055 |
| InChI Key: | CIDKBTYELUXBPC-QHCPKHFHSA-N |