methyl 5-{[3,5-bis(3,4-dimethylphenyl)-1H-pyrazol-1-yl]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[3,5-bis(3,4-dimethylphenyl)-1H-pyrazol-1-yl]methyl}furan-2-carboxylate
methyl 5-{[3,5-bis(3,4-dimethylphenyl)-1H-pyrazol-1-yl]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | Y505-6472 |
| Compound Name: | methyl 5-{[3,5-bis(3,4-dimethylphenyl)-1H-pyrazol-1-yl]methyl}furan-2-carboxylate |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C26 H26 N2 O3 |
| Smiles: | Cc1ccc(cc1C)c1cc(c2ccc(C)c(C)c2)n(Cc2ccc(C(=O)OC)o2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.9609 |
| logD: | 6.9609 |
| logSw: | -5.6202 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.669 |
| InChI Key: | KHEJUFSOZYYOMK-UHFFFAOYSA-N |