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937600-21-0 | 6-CYCLOPROPYL-1-(4-METHOXYPHENYL)-3-METHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-4-C+
CAS No: 937600-21-0 Catalog No: AG01AO9F MDL No:MFCD08556244
Product Description
Catalog Number:
AG01AO9F
Chemical Name:
6-CYCLOPROPYL-1-(4-METHOXYPHENYL)-3-METHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-4-C+
CAS Number:
937600-21-0
Molecular Formula:
C18H19N5O2
Molecular Weight:
337.3758
MDL Number:
MFCD08556244
IUPAC Name:
6-cyclopropyl-1-(4-methoxyphenyl)-3-methylpyrazolo[3,4-b]pyridine-4-carbohydrazide
InChI:
InChI=1S/C18H19N5O2/c1-10-16-14(18(24)21-19)9-15(11-3-4-11)20-17(16)23(22-10)12-5-7-13(25-2)8-6-12/h5-9,11H,3-4,19H2,1-2H3,(H,21,24)
InChI Key:
RTJWUPVYCJUSEW-UHFFFAOYSA-N
SMILES:
NNC(=O)c1cc(nc2c1c(C)nn2c1ccc(cc1)OC)C1CC1
Properties
Complexity:
492
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.154g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
337.383g/mol
Monoisotopic Mass:
337.154g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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