3-{[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]amino}-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
Chemical Structure Depiction of
3-{[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]amino}-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
3-{[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]amino}-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 8014-2897 |
| Compound Name: | 3-{[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]amino}-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one |
| Molecular Weight: | 394.56 |
| Molecular Formula: | C25 H34 N2 O2 |
| Smiles: | CCCCC(C1=C(CC(C)(C)CC1=O)NCCc1c2cc(C)ccc2[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2029 |
| logD: | 5.1204 |
| logSw: | -5.0427 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.736 |
| InChI Key: | OHZVNTHVDFSMKL-UHFFFAOYSA-N |