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3034-31-9

3034-31-9 | 4-Pyridinecarboxamide, N-phenyl-

CAS No: 3034-31-9 Catalog No: AG002ZSN MDL No:MFCD00459246

Product Description

Catalog Number:
AG002ZSN
Chemical Name:
4-Pyridinecarboxamide, N-phenyl-
CAS Number:
3034-31-9
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
MDL Number:
MFCD00459246
IUPAC Name:
N-phenylpyridine-4-carboxamide
InChI:
InChI=1S/C12H10N2O/c15-12(10-6-8-13-9-7-10)14-11-4-2-1-3-5-11/h1-9H,(H,14,15)
InChI Key:
FCTZHFATVFONMW-UHFFFAOYSA-N
SMILES:
O=C(c1ccncc1)Nc1ccccc1
EC Number:
608-466-2
NSC Number:
4266

Properties

Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Literature

Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Single-crystal to single-crystal phase transitions of bis(N-phenylisonicotinamide)silver(I) nitrate reveal cooperativity properties in porous molecular materials. Chemical communications (Cambridge, England) 20070414
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
Nonpolymeric hydrogelator derived from N-(4-pyridyl)isonicotinamide. Langmuir : the ACS journal of surfaces and colloids 20041123

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