methyl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5-dimethoxybenzoate
Chemical Structure Depiction of
methyl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5-dimethoxybenzoate
methyl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5-dimethoxybenzoate
Compound characteristics
| Compound ID: | Y501-2328 |
| Compound Name: | methyl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5-dimethoxybenzoate |
| Molecular Weight: | 447.87 |
| Molecular Formula: | C21 H22 Cl N3 O6 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(C(Nc3cc(c(cc3C(=O)OC)OC)OC)=O)o2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9966 |
| logD: | 2.1602 |
| logSw: | -3.7778 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.19 |
| InChI Key: | PUTXYCCTXCXXAX-UHFFFAOYSA-N |