N-{3-[butyl(methyl)amino]-1-(1-ethyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]-1-(1-ethyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl}-4-methylbenzamide
N-{3-[butyl(methyl)amino]-1-(1-ethyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | D009-0311 |
| Compound Name: | N-{3-[butyl(methyl)amino]-1-(1-ethyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl}-4-methylbenzamide |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C26 H31 N3 O2 |
| Smiles: | CCCCN(C)C(/C(=C/c1cn(CC)c2ccccc12)NC(c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5362 |
| logD: | 3.6435 |
| logSw: | -3.9889 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.292 |
| InChI Key: | NJYYFIYILSXUNQ-UHFFFAOYSA-N |