11-ethoxy-2-(4-methylbenzene-1-sulfonyl)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Chemical Structure Depiction of
11-ethoxy-2-(4-methylbenzene-1-sulfonyl)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
11-ethoxy-2-(4-methylbenzene-1-sulfonyl)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Compound characteristics
| Compound ID: | 8016-8355 |
| Compound Name: | 11-ethoxy-2-(4-methylbenzene-1-sulfonyl)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole |
| Molecular Weight: | 464.5 |
| Molecular Formula: | C24 H20 N2 O6 S |
| Smiles: | CCOC1c2ccccc2Oc2cc(cc3c2c1cn3S(c1ccc(C)cc1)(=O)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1805 |
| logD: | 5.1805 |
| logSw: | -5.1597 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.281 |
| InChI Key: | VNMLKPCTLABZON-XMMPIXPASA-N |