AC1NWTW1
3-(1,3-benzodioxol-5-yl)-5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole
Also Known As: 5-(1,3-benzodioxol-5-yl)-3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-phenyl-4,5-dihydro-1H-pyrazole|3-(1,3-benzodioxol-5-yl)-5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole|(E)-5-(benzo[d][1,3]dioxol-5-yl)-3-(2-(benzo[d][1,3]dioxol-5-yl)vinyl)-1-phenyl-4,5-dihydro-1H-pyrazole|5-(2H-1,3-BENZODIOXOL-5-YL)-3-[(1E)-2-(2H-1,3-BENZODIOXOL-5-YL)ETHENYL]-1-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE
| Molecular Formula | C25H20N2O4 |
|---|---|
| Molecular Weight | 412.1423 g/mol |
| LogP | 5.1648 |
| Topological Polar Surface Area | 52.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.1423 |
| Monoisotopic Mass | 412.1423 |
| Heavy Atoms | 31 |
| Complexity | 1189.3813 |
Chemical Identifiers
| CAS Number | 41296-80-4 |
|---|---|
| SMILES | C1C(N(N=C1/C=C/C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6 |
Product Overview
AC1NWTW1 (CAS 41296-80-4), with molecular formula C25H20N2O4 and molecular weight 412.1423 g/mol. IUPAC: 3-(1,3-benzodioxol-5-yl)-5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-2-phenyl-3,4-dihydropyrazole.
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