Home Other Building Blocks 2-[2-(2-hydroxy-5-methylbenzamido)-1,3-thiazol-4-yl]acetic acid

2-[2-(2-hydroxy-5-methylbenzamido)-1,3-thiazol-4-yl]acetic acid

CAS No.:
1016496-54-0
Catalog Number:
AG019NF0
Molecular Formula:
C13H12N2O4S
Molecular Weight:
292.3104
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Product Description
Catalog Number:
AG019NF0
Chemical Name:
2-[2-(2-hydroxy-5-methylbenzamido)-1,3-thiazol-4-yl]acetic acid
CAS Number:
1016496-54-0
Molecular Formula:
C13H12N2O4S
Molecular Weight:
292.3104
MDL Number:
MFCD09813671
IUPAC Name:
2-[2-[(2-hydroxy-5-methylbenzoyl)amino]-1,3-thiazol-4-yl]acetic acid
InChI:
InChI=1S/C13H12N2O4S/c1-7-2-3-10(16)9(4-7)12(19)15-13-14-8(6-20-13)5-11(17)18/h2-4,6,16H,5H2,1H3,(H,17,18)(H,14,15,19)
InChI Key:
KTOGAUDYZFTWHN-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1csc(n1)NC(=O)c1cc(C)ccc1O
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.052g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
292.309g/mol
Monoisotopic Mass:
292.052g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
128A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties