ethyl 1,2-dimethyl-5-[(3-methylbutanoyl)oxy]-1H-benzo[g]indole-3-carboxylate
Chemical Structure Depiction of
ethyl 1,2-dimethyl-5-[(3-methylbutanoyl)oxy]-1H-benzo[g]indole-3-carboxylate
ethyl 1,2-dimethyl-5-[(3-methylbutanoyl)oxy]-1H-benzo[g]indole-3-carboxylate
Compound characteristics
| Compound ID: | 2729-0763 |
| Compound Name: | ethyl 1,2-dimethyl-5-[(3-methylbutanoyl)oxy]-1H-benzo[g]indole-3-carboxylate |
| Molecular Weight: | 367.44 |
| Molecular Formula: | C22 H25 N O4 |
| Smiles: | CCOC(c1c2cc(c3ccccc3c2n(C)c1C)OC(CC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.631 |
| logD: | 4.631 |
| logSw: | -4.5742 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.92 |
| InChI Key: | YBBVVLNWXVSAJB-UHFFFAOYSA-N |