3-[(4-methoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
3-[(4-methoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Compound characteristics
| Compound ID: | 8015-1998 |
| Compound Name: | 3-[(4-methoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole |
| Molecular Weight: | 481.48 |
| Molecular Formula: | C23 H19 N3 O7 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(=C/c2ccc(cc2)OC)\c2c(cc(cc12)[N+]([O-])=O)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8538 |
| logD: | 4.8538 |
| logSw: | -4.8691 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 105.425 |
| InChI Key: | ZZEHJDWJFBMJAH-UHFFFAOYSA-N |