2-cyano-N-(4-methoxyphenyl)-3-[1-(prop-2-yn-1-yl)-1H-indol-3-yl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-N-(4-methoxyphenyl)-3-[1-(prop-2-yn-1-yl)-1H-indol-3-yl]prop-2-enamide
2-cyano-N-(4-methoxyphenyl)-3-[1-(prop-2-yn-1-yl)-1H-indol-3-yl]prop-2-enamide
Compound characteristics
| Compound ID: | 5609-0477 |
| Compound Name: | 2-cyano-N-(4-methoxyphenyl)-3-[1-(prop-2-yn-1-yl)-1H-indol-3-yl]prop-2-enamide |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C22 H17 N3 O2 |
| Smiles: | COc1ccc(cc1)NC(C(=C/c1cn(CC#C)c2ccccc12)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.979 |
| logD: | 3.9718 |
| logSw: | -4.143 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.912 |
| InChI Key: | DXUIVWYUYTYFRN-UHFFFAOYSA-N |