methyl N-[1-(2-chloro-5-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]glycinate
Chemical Structure Depiction of
methyl N-[1-(2-chloro-5-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]glycinate
methyl N-[1-(2-chloro-5-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]glycinate
Compound characteristics
| Compound ID: | IB07-2108 |
| Compound Name: | methyl N-[1-(2-chloro-5-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]glycinate |
| Molecular Weight: | 376.77 |
| Molecular Formula: | C17 H14 Cl F N4 O3 |
| Smiles: | COC(CNC(c1cnn(c2cc(ccc2[Cl])F)c1n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.45 |
| logD: | 3.45 |
| logSw: | -4.3 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.85 |
| InChI Key: | IFALFAUPNJAQCC-UHFFFAOYSA-N |