propan-2-yl 4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate
Chemical Structure Depiction of
propan-2-yl 4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate
propan-2-yl 4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | 6228-1835 |
| Compound Name: | propan-2-yl 4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)benzoate |
| Molecular Weight: | 415.88 |
| Molecular Formula: | C21 H22 Cl N3 O4 |
| Smiles: | CC(C)OC(c1ccc(cc1)NC(c1ccc(Cn2c(C)c(c(C)n2)[Cl])o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0939 |
| logD: | 4.0931 |
| logSw: | -4.5797 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.885 |
| InChI Key: | IYBQADCFOWHEEK-UHFFFAOYSA-N |