3-(1-{3-[bis(2-methylpropyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one
Chemical Structure Depiction of
3-(1-{3-[bis(2-methylpropyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one
3-(1-{3-[bis(2-methylpropyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one
Compound characteristics
| Compound ID: | D009-0564 |
| Compound Name: | 3-(1-{3-[bis(2-methylpropyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one |
| Molecular Weight: | 476.66 |
| Molecular Formula: | C30 H40 N2 O3 |
| Smiles: | CCOc1ccc(cc1)C(/C=C/c1cn(CC(CN(CC(C)C)CC(C)C)O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9852 |
| logD: | 4.488 |
| logSw: | -5.5131 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.944 |
| InChI Key: | YDNABZRFCLLHQM-SANMLTNESA-N |