methyl 3-methyl-5-(3-nitrobenzamido)-1-phenyl-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 3-methyl-5-(3-nitrobenzamido)-1-phenyl-1H-pyrazole-4-carboxylate
methyl 3-methyl-5-(3-nitrobenzamido)-1-phenyl-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | 8013-9859 |
| Compound Name: | methyl 3-methyl-5-(3-nitrobenzamido)-1-phenyl-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 380.36 |
| Molecular Formula: | C19 H16 N4 O5 |
| Smiles: | Cc1c(C(=O)OC)c(NC(c2cccc(c2)[N+]([O-])=O)=O)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5352 |
| logD: | -0.357 |
| logSw: | -3.0488 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.975 |
| InChI Key: | RRSIUAYMWUOJPR-UHFFFAOYSA-N |