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144275-75-2 | 4-Pyridinecarboxamide, 2-chloro-N-(5-chloro-2-benzoxazolyl)-
CAS No: 144275-75-2 Catalog No: AG001J79 MDL No:
Product Description
Catalog Number:
AG001J79
Chemical Name:
4-Pyridinecarboxamide, 2-chloro-N-(5-chloro-2-benzoxazolyl)-
CAS Number:
144275-75-2
Molecular Formula:
C13H7Cl2N3O2
Molecular Weight:
308.1196
IUPAC Name:
2-chloro-N-(5-chloro-1,3-benzoxazol-2-yl)pyridine-4-carboxamide
InChI:
InChI=1S/C13H7Cl2N3O2/c14-8-1-2-10-9(6-8)17-13(20-10)18-12(19)7-3-4-16-11(15)5-7/h1-6H,(H,17,18,19)
InChI Key:
QNWCDRVEYIRCEG-UHFFFAOYSA-N
SMILES:
Clc1nccc(c1)C(=O)Nc1oc2c(n1)cc(cc2)Cl
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.992g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.118g/mol
Monoisotopic Mass:
306.992g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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