N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-propylurea
Chemical Structure Depiction of
N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-propylurea
N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-propylurea
Compound characteristics
| Compound ID: | V003-0005 |
| Compound Name: | N-{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-propylurea |
| Molecular Weight: | 462.59 |
| Molecular Formula: | C27 H34 N4 O3 |
| Salt: | not_available |
| Smiles: | CCCNC(N(CC1CCCO1)Cc1c(c2ccccc2)nn(C)c1Oc1cccc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5786 |
| logD: | 4.5786 |
| logSw: | -4.4267 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.113 |
| InChI Key: | OVIGEBCDZNWUQS-HSZRJFAPSA-N |