ethyl 1-butyl-2-methyl-5-[(3-nitrobenzoyl)oxy]-1H-benzo[g]indole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-butyl-2-methyl-5-[(3-nitrobenzoyl)oxy]-1H-benzo[g]indole-3-carboxylate
ethyl 1-butyl-2-methyl-5-[(3-nitrobenzoyl)oxy]-1H-benzo[g]indole-3-carboxylate
Compound characteristics
| Compound ID: | 2729-0790 |
| Compound Name: | ethyl 1-butyl-2-methyl-5-[(3-nitrobenzoyl)oxy]-1H-benzo[g]indole-3-carboxylate |
| Molecular Weight: | 474.51 |
| Molecular Formula: | C27 H26 N2 O6 |
| Smiles: | CCCCn1c(C)c(C(=O)OCC)c2cc(c3ccccc3c12)OC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1421 |
| logD: | 6.1421 |
| logSw: | -5.6705 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.793 |
| InChI Key: | ODEKLVKSYQNNLP-UHFFFAOYSA-N |