N'-tert-butyl-N-[(4-fluorophenyl)methyl]-N-{[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}urea
Chemical Structure Depiction of
N'-tert-butyl-N-[(4-fluorophenyl)methyl]-N-{[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}urea
N'-tert-butyl-N-[(4-fluorophenyl)methyl]-N-{[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}urea
Compound characteristics
| Compound ID: | V001-0353 |
| Compound Name: | N'-tert-butyl-N-[(4-fluorophenyl)methyl]-N-{[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}urea |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C30 H33 F N4 O3 |
| Smiles: | Cc1c(CN(Cc2ccc(cc2)F)C(NC(C)(C)C)=O)c(n(c2ccccc2)n1)Oc1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.0343 |
| logD: | 6.0343 |
| logSw: | -5.6276 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.815 |
| InChI Key: | FDZIDOWDQBAMRR-UHFFFAOYSA-N |