AC1NNGAL
N-[3-[2-(2,2-dimethylpropanoyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide
Also Known As: F0621-0547|N-(3-(5-(4-methoxyphenyl)-1-pivaloyl-4,5-dihydro-1H-pyrazol-3-yl)phenyl)methanesulfonamide|N-{3-[1-(2,2-dimethylpropanoyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide|N-[3-[2-(2,2-dimethylpropanoyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide
| Molecular Formula | C22H27N3O4S |
|---|---|
| Molecular Weight | 429.17224 g/mol |
| LogP | 3.7905 |
| Topological Polar Surface Area | 88.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.17224 |
| Monoisotopic Mass | 429.17224 |
| Heavy Atoms | 30 |
| Complexity | 1070.3066 |
Chemical Identifiers
| CAS Number | 851718-75-7 |
|---|---|
| SMILES | CC(C)(C)C(=O)N1C(CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C)C3=CC=C(C=C3)OC |
Product Overview
AC1NNGAL (CAS 851718-75-7), with molecular formula C22H27N3O4S and molecular weight 429.17224 g/mol. IUPAC: N-[3-[2-(2,2-dimethylpropanoyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide.
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