106753-78-0
6-AMINO-3-METHYL-4-(4-PYRIDINYL)-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE
Name6-AMINO-3-METHYL-4-(4-PYRIDINYL)-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE
1Identification
【Name】
6-AMINO-3-METHYL-4-(4-PYRIDINYL)-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE
【CAS】
【MDL】
MFCD00581077
【English Synonyms】
【Formula】
C13 H11 N5 O
【MolWeight】
253.264
【Inchi】
InChI=1S/C13H11N5O/c1-7-10-11(8-2-4-16-5-3-8)9(6-14)12(15)19-13(10)18-17-7/h2-5,11H,15H2,1H3,(H,17,18)
【InChIKey】
InChIKey=SSECTZQWGHOJHV-UHFFFAOYSA-N
【SMILES】
Cc1c2c([nH]n1)OC(=C(C2c3ccncc3)C#N)N
【MOL File】
6-AMINO-3-METHYL-4-(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-AMINO-3-METHYL-4-(4-PYRIDINYL)-1,4-DIHYDROPYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE.cml