N-butyl-N'-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}urea
Chemical Structure Depiction of
N-butyl-N'-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}urea
N-butyl-N'-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}urea
Compound characteristics
| Compound ID: | Y205-0021 |
| Compound Name: | N-butyl-N'-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}urea |
| Molecular Weight: | 320.82 |
| Molecular Formula: | C16 H21 Cl N4 O |
| Smiles: | CCCCNC(Nc1cc(C)n(Cc2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5728 |
| logD: | 3.572 |
| logSw: | -3.8671 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.473 |
| InChI Key: | MGXAQWHBAHLMSG-UHFFFAOYSA-N |