N-(3-chloro-2-methylphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
N-(3-chloro-2-methylphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | 8017-1041 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 308.72 |
| Molecular Formula: | C13 H13 Cl N4 O3 |
| Smiles: | CCn1cc(c(C(Nc2cccc(c2C)[Cl])=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7894 |
| logD: | 2.5141 |
| logSw: | -3.3857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.761 |
| InChI Key: | HHSDDLQSDBXAQL-UHFFFAOYSA-N |