N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}urea
Compound characteristics
| Compound ID: | Y206-5947 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}urea |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C22 H24 N4 O3 |
| Smiles: | Cc1ccc(Cn2c(C)c(c(C)n2)NC(Nc2ccc3c(c2)OCCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6626 |
| logD: | 2.6625 |
| logSw: | -2.9991 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.251 |
| InChI Key: | PFHCLKGEQJUPEZ-UHFFFAOYSA-N |