9-bromo-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Chemical Structure Depiction of
9-bromo-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
9-bromo-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Compound characteristics
| Compound ID: | 8016-6015 |
| Compound Name: | 9-bromo-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole |
| Molecular Weight: | 345.15 |
| Molecular Formula: | C15 H9 Br N2 O3 |
| Smiles: | C1c2cc(ccc2Oc2cc(cc3c2c1c[nH]3)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.5686 |
| logD: | 4.5686 |
| logSw: | -4.9455 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.635 |
| InChI Key: | NFNPUXIWAPSOCZ-UHFFFAOYSA-N |