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250674-48-7 | 2,7-Naphthyridine-3-carbo...
CAS No: 250674-48-7 Catalog No: AG002QCV MDL No:MFCD17015928
Product Description
Catalog Number:
AG002QCV
Chemical Name:
2,7-Naphthyridine-3-carbo...
CAS Number:
250674-48-7
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD17015928
IUPAC Name:
2,7-naphthyridine-3-carboxylic acid
InChI:
InChI=1S/C9H6N2O2/c12-9(13)8-3-6-1-2-10-4-7(6)5-11-8/h1-5H,(H,12,13)
InChI Key:
REGNBBZZTQVCJU-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncc2c(c1)ccnc2
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.159g/mol
Monoisotopic Mass:
174.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Isoquinoline-6-carboxamides as potent and selective anti-human cytomegalovirus (HCMV) inhibitors. | Bioorganic & medicinal chemistry letters 19990906 |
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