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88796-49-0 | 1H-Pyrrolo[3,2-b]pyridine-3-carboxamide, 6-amino-1-phenyl-
CAS No: 88796-49-0 Catalog No: AG004B0N MDL No:
Product Description
Catalog Number:
AG004B0N
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine-3-carboxamide, 6-amino-1-phenyl-
CAS Number:
88796-49-0
Molecular Formula:
C14H12N4O
Molecular Weight:
252.2713
IUPAC Name:
6-amino-1-phenylpyrrolo[3,2-b]pyridine-3-carboxamide
InChI:
InChI=1S/C14H12N4O/c15-9-6-12-13(17-7-9)11(14(16)19)8-18(12)10-4-2-1-3-5-10/h1-8H,15H2,(H2,16,19)
InChI Key:
LHAXXAIRFDKDKC-UHFFFAOYSA-N
SMILES:
Nc1cnc2c(c1)n(cc2C(=O)N)c1ccccc1
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.101g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.277g/mol
Monoisotopic Mass:
252.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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