methyl 5-{[3,5-bis(3,4-dimethylphenyl)-4-methyl-1H-pyrazol-1-yl]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[3,5-bis(3,4-dimethylphenyl)-4-methyl-1H-pyrazol-1-yl]methyl}furan-2-carboxylate
methyl 5-{[3,5-bis(3,4-dimethylphenyl)-4-methyl-1H-pyrazol-1-yl]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | Y505-6356 |
| Compound Name: | methyl 5-{[3,5-bis(3,4-dimethylphenyl)-4-methyl-1H-pyrazol-1-yl]methyl}furan-2-carboxylate |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C27 H28 N2 O3 |
| Smiles: | Cc1ccc(cc1C)c1c(C)c(c2ccc(C)c(C)c2)n(Cc2ccc(C(=O)OC)o2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.9405 |
| logD: | 6.9405 |
| logSw: | -5.6348 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.215 |
| InChI Key: | XRIAJAVDSFIWNT-UHFFFAOYSA-N |