N-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-methoxy-4-nitrophenyl)urea
Chemical Structure Depiction of
N-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-methoxy-4-nitrophenyl)urea
N-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-methoxy-4-nitrophenyl)urea
Compound characteristics
| Compound ID: | Y206-9448 |
| Compound Name: | N-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-methoxy-4-nitrophenyl)urea |
| Molecular Weight: | 413.41 |
| Molecular Formula: | C20 H20 F N5 O4 |
| Smiles: | Cc1c(c(C)n(Cc2ccccc2F)n1)NC(Nc1ccc(cc1OC)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3958 |
| logD: | 3.368 |
| logSw: | -3.7726 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.742 |
| InChI Key: | PJNUJRWAVKHFCQ-UHFFFAOYSA-N |