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1301738-68-0 | 4-Phenyl-2-(2-pyridyl)thiazole-5-carboxylic acid
CAS No: 1301738-68-0 Catalog No: AG01F9HO MDL No:MFCD16251584
Product Description
Catalog Number:
AG01F9HO
Chemical Name:
4-Phenyl-2-(2-pyridyl)thiazole-5-carboxylic acid
CAS Number:
1301738-68-0
Molecular Formula:
C15H10N2O2S
Molecular Weight:
282.3171
MDL Number:
MFCD16251584
IUPAC Name:
4-phenyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C15H10N2O2S/c18-15(19)13-12(10-6-2-1-3-7-10)17-14(20-13)11-8-4-5-9-16-11/h1-9H,(H,18,19)
InChI Key:
AFWYDGNOZTZZDG-UHFFFAOYSA-N
SMILES:
OC(=O)c1sc(nc1c1ccccc1)c1ccccn1
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.046g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.317g/mol
Monoisotopic Mass:
282.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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