N'-tert-butyl-N-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
N'-tert-butyl-N-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Compound characteristics
| Compound ID: | V027-0139 |
| Compound Name: | N'-tert-butyl-N-{[5-(3-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea |
| Molecular Weight: | 492.62 |
| Molecular Formula: | C28 H36 N4 O4 |
| Salt: | not_available |
| Smiles: | Cc1c(CN(CC2CCCO2)C(NC(C)(C)C)=O)c(n(c2ccccc2)n1)Oc1cccc(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7944 |
| logD: | 4.7944 |
| logSw: | -4.7169 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.296 |
| InChI Key: | XSJDNAXBYWZOTI-XMMPIXPASA-N |