AC1MJKHV
6-amino-4-(1,3-benzodioxol-5-yl)-3-methyl-1-phenyl-4H-pyrano[3,2-d]pyrazole-5-carbonitrile
Also Known As: BAS 00641227|J2.127.370H|SR-01000430586-1|6-amino-4-(1,3-benzodioxol-5-yl)-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile|6-amino-4-(1,3-benzodioxol-5-yl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile|1-Phenyl-3-methyl-4-(1,3-benzodioxole-5-yl)-6-amino-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile|4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-6-amino-3-methyl-1-phenyl-4H-pyrano[3,2-d ]pyrazole-5-carbonitrile|6-Amino-1,4-dihydro-3-methyl-4-[3,4-(methylenedioxy)phenyl]-1-phenylpyrano[2,3-c]pyrazole-5-carbonitrile|6-amino-4-(2H-1,3-benzodioxol-5-yl)-3-methyl-1-phenyl-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile|6-amino-4-(benzo[d][1,3]dioxol-5-yl)-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C21H16N4O3 |
|---|---|
| Molecular Weight | 372.12225 g/mol |
| LogP | 3.1276 |
| Topological Polar Surface Area | 95.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 372.12225 |
| Monoisotopic Mass | 372.12225 |
| Heavy Atoms | 28 |
| Complexity | 1158.384 |
Chemical Identifiers
| CAS Number | 313702-96-4 |
|---|---|
| SMILES | CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5 |
Product Overview
AC1MJKHV (CAS 313702-96-4), with molecular formula C21H16N4O3 and molecular weight 372.12225 g/mol. IUPAC: 6-amino-4-(1,3-benzodioxol-5-yl)-3-methyl-1-phenyl-4H-pyrano[3,2-d]pyrazole-5-carbonitrile.
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