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Home > Pyridines > 130421-48-6
130421-48-6 | 1H-Pyrazole-3-carboxamide, 5-phenyl-N-2-pyridinyl-
CAS No: 130421-48-6 Catalog No: AG000UEY MDL No:
Product Description
Catalog Number:
AG000UEY
Chemical Name:
1H-Pyrazole-3-carboxamide, 5-phenyl-N-2-pyridinyl-
CAS Number:
130421-48-6
Molecular Formula:
C15H12N4O
Molecular Weight:
264.2820
IUPAC Name:
3-phenyl-N-pyridin-2-yl-1H-pyrazole-5-carboxamide
InChI:
InChI=1S/C15H12N4O/c20-15(17-14-8-4-5-9-16-14)13-10-12(18-19-13)11-6-2-1-3-7-11/h1-10H,(H,18,19)(H,16,17,20)
InChI Key:
KZRJWTXLLXLCAQ-UHFFFAOYSA-N
SMILES:
O=C(c1n[nH]c(c1)c1ccccc1)Nc1ccccn1
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.101g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.288g/mol
Monoisotopic Mass:
264.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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