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144060-98-0 | 4-Methyl-2-(pyridin-4-yl);thiazole-5-carboxylic acid
CAS No: 144060-98-0 Catalog No: AG003LPZ MDL No:MFCD00171757
Product Description
Catalog Number:
AG003LPZ
Chemical Name:
4-Methyl-2-(pyridin-4-yl);thiazole-5-carboxylic acid
CAS Number:
144060-98-0
Molecular Formula:
C10H8N2O2S
Molecular Weight:
220.2477
MDL Number:
MFCD00171757
IUPAC Name:
4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C10H8N2O2S/c1-6-8(10(13)14)15-9(12-6)7-2-4-11-5-3-7/h2-5H,1H3,(H,13,14)
InChI Key:
WAIPVXWDQQHMQG-UHFFFAOYSA-N
SMILES:
OC(=O)c1sc(nc1C)c1ccncc1
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.031g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.246g/mol
Monoisotopic Mass:
220.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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