3-[(2-ethoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Chemical Structure Depiction of
3-[(2-ethoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
3-[(2-ethoxyphenyl)methylidene]-1-(4-methylbenzene-1-sulfonyl)-4,6-dinitro-2,3-dihydro-1H-indole
Compound characteristics
| Compound ID: | 8016-2147 |
| Compound Name: | 3-[(2-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: | CCOc1ccccc1/C=C1CN(c2cc(cc(c/12)[N+]([O-])=O)[N+]([O-])=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5078 |
| logD: | 5.5078 |
| logSw: | -5.5453 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 105.091 |
| InChI Key: | LNHRZDMWWICZNO-UHFFFAOYSA-N |