2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}acetamide
Chemical Structure Depiction of
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}acetamide
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}acetamide
Compound characteristics
| Compound ID: | Y500-5974 |
| Compound Name: | 2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}acetamide |
| Molecular Weight: | 494.94 |
| Molecular Formula: | C24 H23 Cl N6 O4 |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)Oc2ccccc2)n1)NC(Cn1c(C)c(c(n1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4631 |
| logD: | 3.463 |
| logSw: | -4.3773 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.041 |
| InChI Key: | PEXRGCBKVWAZRC-UHFFFAOYSA-N |