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

2-[4-(4-methoxyphenyl)-2-methyl-1,3-thiazol-5-yl]acetic acid

CAS No.:
553629-28-0
Catalog Number:
AG01BXWV
Molecular Formula:
C13H13NO3S
Molecular Weight:
263.3122
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Product Description
Catalog Number:
AG01BXWV
Chemical Name:
2-[4-(4-methoxyphenyl)-2-methyl-1,3-thiazol-5-yl]acetic acid
CAS Number:
553629-28-0
Molecular Formula:
C13H13NO3S
Molecular Weight:
263.3122
MDL Number:
MFCD03450247
IUPAC Name:
2-[4-(4-methoxyphenyl)-2-methyl-1,3-thiazol-5-yl]acetic acid
InChI:
InChI=1S/C13H13NO3S/c1-8-14-13(11(18-8)7-12(15)16)9-3-5-10(17-2)6-4-9/h3-6H,7H2,1-2H3,(H,15,16)
InChI Key:
GMCPJQBHRRYPTP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc(sc1CC(=O)O)C
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.062g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.311g/mol
Monoisotopic Mass:
263.062g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
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
Properties