4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3-hydroxyphenyl)butanamide
Chemical Structure Depiction of
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3-hydroxyphenyl)butanamide
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3-hydroxyphenyl)butanamide
Compound characteristics
| Compound ID: | C163-0010 |
| Compound Name: | 4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3-hydroxyphenyl)butanamide |
| Molecular Weight: | 338.75 |
| Molecular Formula: | C14 H15 Cl N4 O4 |
| Smiles: | Cc1c(c(nn1CCCC(Nc1cccc(c1)O)=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.2721 |
| logD: | 1.2651 |
| logSw: | -2.5252 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.003 |
| InChI Key: | AGWMHOUTEOVZEY-UHFFFAOYSA-N |