N-[(furan-2-yl)methyl]-N-{[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N-{[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
N-[(furan-2-yl)methyl]-N-{[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V006-2921 |
| Compound Name: | N-[(furan-2-yl)methyl]-N-{[3-methyl-5-(3-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N'-(propan-2-yl)urea |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | CC(C)NC(N(Cc1c(C)nn(c2ccccc2)c1Oc1cccc(C)c1)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.601 |
| logD: | 5.601 |
| logSw: | -5.4585 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.997 |
| InChI Key: | XXCNUQVWQHSMTR-UHFFFAOYSA-N |