ethyl N-({1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-({1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-beta-alaninate
ethyl N-({1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-beta-alaninate
Compound characteristics
| Compound ID: | Y206-9564 |
| Compound Name: | ethyl N-({1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}carbamoyl)-beta-alaninate |
| Molecular Weight: | 362.4 |
| Molecular Formula: | C18 H23 F N4 O3 |
| Smiles: | CCOC(CCNC(Nc1c(C)nn(Cc2ccccc2F)c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6697 |
| logD: | 1.6697 |
| logSw: | -2.2137 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.021 |
| InChI Key: | NCLDULRNGZJJIL-UHFFFAOYSA-N |