4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-hydroxy-5-methylphenyl)butanamide
Chemical Structure Depiction of
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-hydroxy-5-methylphenyl)butanamide
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-hydroxy-5-methylphenyl)butanamide
Compound characteristics
| Compound ID: | C163-0011 |
| Compound Name: | 4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-hydroxy-5-methylphenyl)butanamide |
| Molecular Weight: | 352.78 |
| Molecular Formula: | C15 H17 Cl N4 O4 |
| Smiles: | Cc1ccc(c(c1)NC(CCCn1c(C)c(c(n1)[N+]([O-])=O)[Cl])=O)O |
| Stereo: | ACHIRAL |
| logP: | 1.5294 |
| logD: | 1.5291 |
| logSw: | -2.8076 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.236 |
| InChI Key: | LROBJLZJUMMEMV-UHFFFAOYSA-N |