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Home > Pyridines > 116539-68-5
116539-68-5 | 2-Naphthalenecarboxamide, 3-hydroxy-N-4-pyridinyl-
CAS No: 116539-68-5 Catalog No: AG000CR5 MDL No:
Product Description
Catalog Number:
AG000CR5
Chemical Name:
2-Naphthalenecarboxamide, 3-hydroxy-N-4-pyridinyl-
CAS Number:
116539-68-5
Molecular Formula:
C16H12N2O2
Molecular Weight:
264.2787
IUPAC Name:
3-hydroxy-N-pyridin-4-ylnaphthalene-2-carboxamide
InChI:
InChI=1S/C16H12N2O2/c19-15-10-12-4-2-1-3-11(12)9-14(15)16(20)18-13-5-7-17-8-6-13/h1-10,19H,(H,17,18,20)
InChI Key:
CPYHCCYWYRYLBR-UHFFFAOYSA-N
SMILES:
O=C(c1cc2ccccc2cc1O)Nc1ccncc1
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.284g/mol
Monoisotopic Mass:
264.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| Structure-activity relationship studies of naphthol AS-E and its derivatives as anticancer agents by inhibiting CREB-mediated gene transcription. | Bioorganic & medicinal chemistry 20121201 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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