ethyl 4-(2-methylpropane-1-sulfonyl)-6-nitro-1-phenyl-1H-indazole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-methylpropane-1-sulfonyl)-6-nitro-1-phenyl-1H-indazole-3-carboxylate
ethyl 4-(2-methylpropane-1-sulfonyl)-6-nitro-1-phenyl-1H-indazole-3-carboxylate
Compound characteristics
| Compound ID: | 8013-3045 |
| Compound Name: | ethyl 4-(2-methylpropane-1-sulfonyl)-6-nitro-1-phenyl-1H-indazole-3-carboxylate |
| Molecular Weight: | 431.47 |
| Molecular Formula: | C20 H21 N3 O6 S |
| Smiles: | CCOC(c1c2c(cc(cc2n(c2ccccc2)n1)[N+]([O-])=O)S(CC(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9306 |
| logD: | 3.9306 |
| logSw: | -4.1067 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 97.525 |
| InChI Key: | VWXDVZVENSHAPO-UHFFFAOYSA-N |