4-[3-{3-[(methanesulfonyl)amino]phenyl}-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[3-{3-[(methanesulfonyl)amino]phenyl}-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
4-[3-{3-[(methanesulfonyl)amino]phenyl}-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | C327-0168 |
| Compound Name: | 4-[3-{3-[(methanesulfonyl)amino]phenyl}-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | COc1ccc(cc1)C1CC(c2cccc(c2)NS(C)(=O)=O)=NN1C(CCC(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1443 |
| logD: | -0.8052 |
| logSw: | -2.8347 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.654 |
| InChI Key: | KYIDKSWBCHMYCE-LJQANCHMSA-N |