81000-12-6
6-AMINO-4-(4-METHOXYPHENYL)-3-METHYL-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE
Name6-AMINO-4-(4-METHOXYPHENYL)-3-METHYL-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE
1Identification
【Name】
6-AMINO-4-(4-METHOXYPHENYL)-3-METHYL-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE
【CAS】
【MDL】
MFCD00418336
【English Synonyms】
【Formula】
C15 H14 N4 O2
【MolWeight】
282.302
【Inchi】
InChI=1S/C15H14N4O2/c1-8-12-13(9-3-5-10(20-2)6-4-9)11(7-16)14(17)21-15(12)19-18-8/h3-6,13H,17H2,1-2H3,(H,18,19)
【InChIKey】
InChIKey=IGGISYUBGOYLQH-UHFFFAOYSA-N
【SMILES】
Cc1c2c([nH]n1)OC(=C(C2c3ccc(cc3)OC)C#N)N
【MOL File】
6-AMINO-4-(4-METHOXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-AMINO-4-(4-METHOXYPHENYL)-3-METHYL-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE.cml