2-(4-methylbenzene-1-sulfonyl)-4-nitro-9-(phenyldiazenyl)-1,2-dihydro[1]benzoxepino[4,3,2-cd]indole
Chemical Structure Depiction of
2-(4-methylbenzene-1-sulfonyl)-4-nitro-9-(phenyldiazenyl)-1,2-dihydro[1]benzoxepino[4,3,2-cd]indole
2-(4-methylbenzene-1-sulfonyl)-4-nitro-9-(phenyldiazenyl)-1,2-dihydro[1]benzoxepino[4,3,2-cd]indole
Compound characteristics
| Compound ID: | 8015-3163 |
| Compound Name: | 2-(4-methylbenzene-1-sulfonyl)-4-nitro-9-(phenyldiazenyl)-1,2-dihydro[1]benzoxepino[4,3,2-cd]indole |
| Molecular Weight: | 524.55 |
| Molecular Formula: | C28 H20 N4 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CC2=Cc3cc(ccc3Oc3cc(cc1c23)[N+]([O-])=O)/N=N/c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8981 |
| logD: | 6.8981 |
| logSw: | -5.881 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 93.904 |
| InChI Key: | UHLWWFBMSOJVRY-UHFFFAOYSA-N |