4-(1H-indol-3-yl)but-3-en-2-one
Chemical Structure Depiction of
4-(1H-indol-3-yl)but-3-en-2-one
4-(1H-indol-3-yl)but-3-en-2-one
Compound characteristics
| Compound ID: | 0350-0062 |
| Compound Name: | 4-(1H-indol-3-yl)but-3-en-2-one |
| Molecular Weight: | 185.22 |
| Molecular Formula: | C12 H11 N O |
| Smiles: | CC(/C=C/c1c[nH]c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3261 |
| logD: | 2.3261 |
| logSw: | -2.7827 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.4442 |
| InChI Key: | YJRJWAUDTYJBNF-UHFFFAOYSA-N |