2-[5-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[1-hydroxy-4-(methylsulfanyl)butan-2-yl]acetamide
Chemical Structure Depiction of
2-[5-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[1-hydroxy-4-(methylsulfanyl)butan-2-yl]acetamide
2-[5-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[1-hydroxy-4-(methylsulfanyl)butan-2-yl]acetamide
Compound characteristics
| Compound ID: | IB07-4419 |
| Compound Name: | 2-[5-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[1-hydroxy-4-(methylsulfanyl)butan-2-yl]acetamide |
| Molecular Weight: | 351.44 |
| Molecular Formula: | C17 H22 F N3 O2 S |
| Smiles: | Cc1c(CC(NC(CCSC)CO)=O)c(c2ccc(cc2)F)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.09 |
| logD: | 2.09 |
| logSw: | -2.82 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 148.62 |
| InChI Key: | XSMQAYKWYYCEJO-AWEZNQCLSA-N |