butyl 4-[2-cyano-3-(1H-indol-3-yl)prop-2-enamido]benzoate
Chemical Structure Depiction of
butyl 4-[2-cyano-3-(1H-indol-3-yl)prop-2-enamido]benzoate
butyl 4-[2-cyano-3-(1H-indol-3-yl)prop-2-enamido]benzoate
Compound characteristics
| Compound ID: | 3771-9702 |
| Compound Name: | butyl 4-[2-cyano-3-(1H-indol-3-yl)prop-2-enamido]benzoate |
| Molecular Weight: | 387.44 |
| Molecular Formula: | C23 H21 N3 O3 |
| Smiles: | CCCCOC(c1ccc(cc1)NC(C(=C\c1c[nH]c2ccccc12)\C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2036 |
| logD: | 5.0625 |
| logSw: | -5.321 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.304 |
| InChI Key: | KTLSJPKABPIFIN-UHFFFAOYSA-N |