4-chloro-N-(2-methoxy-5-methylphenyl)-5-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-chloro-N-(2-methoxy-5-methylphenyl)-5-nitro-1H-pyrazole-3-carboxamide
4-chloro-N-(2-methoxy-5-methylphenyl)-5-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-1248 |
| Compound Name: | 4-chloro-N-(2-methoxy-5-methylphenyl)-5-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 310.69 |
| Molecular Formula: | C12 H11 Cl N4 O4 |
| Smiles: | Cc1ccc(c(c1)NC(c1c(c([nH]n1)[N+]([O-])=O)[Cl])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.3974 |
| logD: | 2.3388 |
| logSw: | -3.5843 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.108 |
| InChI Key: | YSVRCGCAKLUHFK-UHFFFAOYSA-N |