GMN8LFK27Q
1-[4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonyl-2-methylpropane-2-sulfonic acid
Also Known As: 1-({4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl}sulfonyl)-2-methylpropane-2-sulfonic acid|1-[[4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]-2-methyl-2-propanesulfonic acid|1-[[4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]-2-methylpropane-2-sulfonic acid|1-[4-[3-(4-chlorophenyl)-4,5-dihydropyrazol-1-yl]phenyl]sulfonyl-2-methyl-propane-2-sulfonic Acid|1-[4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonyl-2-methylpropane-2-sulfonic acid|2-Propanesulfonic acid, 1-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]-2-methyl-
| Molecular Formula | C19H21ClN2O5S2 |
|---|---|
| Molecular Weight | 456.05804 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.05804 |
| Monoisotopic Mass | 456.05804 |
| Heavy Atoms | 29 |
| Complexity | 814.0 |
Chemical Identifiers
| CAS Number | 220150-84-5 |
|---|---|
| SMILES | CC(C)(CS(=O)(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl)S(=O)(=O)O |
| InChIKey | UOATYFBVXLLHPH-UHFFFAOYSA-N |
Product Overview
GMN8LFK27Q (CAS 220150-84-5), with molecular formula C19H21ClN2O5S2 and molecular weight 456.05804 g/mol. IUPAC: 1-[4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonyl-2-methylpropane-2-sulfonic acid.
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