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15935-96-3 | 1,8-Naphthyridine-3-carboxamide, 2-amino-
CAS No: 15935-96-3 Catalog No: AG001QMY MDL No:
Product Description
Catalog Number:
AG001QMY
Chemical Name:
1,8-Naphthyridine-3-carboxamide, 2-amino-
CAS Number:
15935-96-3
Molecular Formula:
C9H8N4O
Molecular Weight:
188.1860
IUPAC Name:
2-amino-1,8-naphthyridine-3-carboxamide
InChI:
InChI=1S/C9H8N4O/c10-7-6(8(11)14)4-5-2-1-3-12-9(5)13-7/h1-4H,(H2,11,14)(H2,10,12,13)
InChI Key:
HPADGDFXUYBWMU-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc2cccnc2nc1N
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.07g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.19g/mol
Monoisotopic Mass:
188.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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