ethyl 1-{4-[methyl(propyl)carbamoyl]phenyl}-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[methyl(propyl)carbamoyl]phenyl}-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate
ethyl 1-{4-[methyl(propyl)carbamoyl]phenyl}-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V014-8941 |
| Compound Name: | ethyl 1-{4-[methyl(propyl)carbamoyl]phenyl}-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 385.51 |
| Molecular Formula: | C22 H31 N3 O3 |
| Smiles: | CCCN(C)C(c1ccc(cc1)n1c(cc(C(=O)OCC)n1)C(CC)CC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1963 |
| logD: | 4.1963 |
| logSw: | -4.0638 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.487 |
| InChI Key: | FXLGIHPJOSDVRY-UHFFFAOYSA-N |