N-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(4-nitrophenyl)urea
Chemical Structure Depiction of
N-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(4-nitrophenyl)urea
N-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(4-nitrophenyl)urea
Compound characteristics
| Compound ID: | Y205-6905 |
| Compound Name: | N-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(4-nitrophenyl)urea |
| Molecular Weight: | 406.23 |
| Molecular Formula: | C17 H13 Cl2 N5 O3 |
| Smiles: | C(c1ccc(c(c1)[Cl])[Cl])n1ccc(NC(Nc2ccc(cc2)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6915 |
| logD: | 4.6914 |
| logSw: | -5.0838 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.879 |
| InChI Key: | AZDGDYUMWGQJCR-UHFFFAOYSA-N |