3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-propanoylcyclohex-2-en-1-one
Chemical Structure Depiction of
3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-propanoylcyclohex-2-en-1-one
3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-propanoylcyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 8014-2883 |
| Compound Name: | 3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-propanoylcyclohex-2-en-1-one |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C29 H34 N2 O3 |
| Smiles: | CCC(C1=C(CC(C)(C)CC1=O)NCCc1c2cc(ccc2[nH]c1C)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1349 |
| logD: | 5.0524 |
| logSw: | -5.2816 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.964 |
| InChI Key: | OALATOONQPXSHH-UHFFFAOYSA-N |