2-butanoyl-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}cyclohex-2-en-1-one
Chemical Structure Depiction of
2-butanoyl-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}cyclohex-2-en-1-one
2-butanoyl-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}cyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 8014-2421 |
| Compound Name: | 2-butanoyl-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}cyclohex-2-en-1-one |
| Molecular Weight: | 338.45 |
| Molecular Formula: | C21 H26 N2 O2 |
| Smiles: | CCCC(C1=C(CCCC1=O)NCCc1c2ccccc2[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5667 |
| logD: | 3.5313 |
| logSw: | -3.8005 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.736 |
| InChI Key: | KFPPDXOQNIMFNZ-UHFFFAOYSA-N |