methyl 3-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 3-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate
methyl 3-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | Y501-2326 |
| Compound Name: | methyl 3-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate |
| Molecular Weight: | 387.82 |
| Molecular Formula: | C19 H18 Cl N3 O4 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(C(Nc3cccc(c3)C(=O)OC)=O)o2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6696 |
| logD: | 3.6696 |
| logSw: | -4.3296 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.627 |
| InChI Key: | SQBSRJDDDQFNLE-UHFFFAOYSA-N |