ethyl 1-{4-[(4-phenylbutyl)carbamoyl]phenyl}-5-(propan-2-yl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(4-phenylbutyl)carbamoyl]phenyl}-5-(propan-2-yl)-1H-pyrazole-3-carboxylate
ethyl 1-{4-[(4-phenylbutyl)carbamoyl]phenyl}-5-(propan-2-yl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V008-4416 |
| Compound Name: | ethyl 1-{4-[(4-phenylbutyl)carbamoyl]phenyl}-5-(propan-2-yl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C26 H31 N3 O3 |
| Smiles: | CCOC(c1cc(C(C)C)n(c2ccc(cc2)C(NCCCCc2ccccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1103 |
| logD: | 5.1103 |
| logSw: | -4.9272 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.341 |
| InChI Key: | DSNUPLIYUFDIJE-UHFFFAOYSA-N |