methyl 2-({1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}carbamamido)benzoate
Chemical Structure Depiction of
methyl 2-({1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}carbamamido)benzoate
methyl 2-({1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}carbamamido)benzoate
Compound characteristics
| Compound ID: | Y205-2303 |
| Compound Name: | methyl 2-({1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}carbamamido)benzoate |
| Molecular Weight: | 419.27 |
| Molecular Formula: | C19 H16 Cl2 N4 O3 |
| Smiles: | COC(c1ccccc1NC(Nc1cnn(Cc2ccc(cc2[Cl])[Cl])c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5379 |
| logD: | 4.5371 |
| logSw: | -4.6114 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.523 |
| InChI Key: | PADNSCAMBVFLIC-UHFFFAOYSA-N |