3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
Chemical Structure Depiction of
3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 8014-2896 |
| Compound Name: | 3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one |
| Molecular Weight: | 486.66 |
| Molecular Formula: | C31 H38 N2 O3 |
| Smiles: | CCCCC(C1=C(CC(C)(C)CC1=O)NCCc1c2cc(ccc2[nH]c1C)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.206 |
| logD: | 6.1235 |
| logSw: | -5.523 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.964 |
| InChI Key: | HUXLRKOFNGSTDO-UHFFFAOYSA-N |