3-[(4-ethoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Chemical Structure Depiction of
3-[(4-ethoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
3-[(4-ethoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Compound characteristics
| Compound ID: | 8015-6879 |
| Compound Name: | 3-[(4-ethoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole |
| Molecular Weight: | 495.51 |
| Molecular Formula: | C24 H21 N3 O7 S |
| Smiles: | CCOc1ccc(/C=C2CN(c3cc(cc(c/23)[N+]([O-])=O)[N+]([O-])=O)S(c2ccc(C)cc2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2404 |
| logD: | 5.2404 |
| logSw: | -5.2637 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 105.004 |
| InChI Key: | NLEFDMBJIZNHFV-UHFFFAOYSA-N |