1-(4-methylbenzene-1-sulfonyl)-3-[(5-methylfuran-2-yl)methylidene]-4,6-dinitro-2,3-dihydro-1H-indole
Chemical Structure Depiction of
1-(4-methylbenzene-1-sulfonyl)-3-[(5-methylfuran-2-yl)methylidene]-4,6-dinitro-2,3-dihydro-1H-indole
1-(4-methylbenzene-1-sulfonyl)-3-[(5-methylfuran-2-yl)methylidene]-4,6-dinitro-2,3-dihydro-1H-indole
Compound characteristics
| Compound ID: | 8015-3174 |
| Compound Name: | 1-(4-methylbenzene-1-sulfonyl)-3-[(5-methylfuran-2-yl)methylidene]-4,6-dinitro-2,3-dihydro-1H-indole |
| Molecular Weight: | 455.44 |
| Molecular Formula: | C21 H17 N3 O7 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(=C/c2ccc(C)o2)\c2c(cc(cc12)[N+]([O-])=O)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7232 |
| logD: | 4.7232 |
| logSw: | -4.7795 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 105.144 |
| InChI Key: | MUZSBQIMZMDCSL-UHFFFAOYSA-N |