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168127-32-0 | Acetic acid, 2-[4-[2-[(4-methylphenyl)amino]-4-thiazolyl]phenoxy]-, ethyl ester
CAS No: 168127-32-0 Catalog No: AG001XTR MDL No:
Product Description
Catalog Number:
AG001XTR
Chemical Name:
Acetic acid, 2-[4-[2-[(4-methylphenyl)amino]-4-thiazolyl]phenoxy]-, ethyl ester
CAS Number:
168127-32-0
Molecular Formula:
C20H20N2O3S
Molecular Weight:
368.4494
IUPAC Name:
ethyl 2-[4-[2-(4-methylanilino)-1,3-thiazol-4-yl]phenoxy]acetate
InChI:
InChI=1S/C20H20N2O3S/c1-3-24-19(23)12-25-17-10-6-15(7-11-17)18-13-26-20(22-18)21-16-8-4-14(2)5-9-16/h4-11,13H,3,12H2,1-2H3,(H,21,22)
InChI Key:
OFHHUWUBFXVGCK-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1ccc(cc1)c1csc(n1)Nc1ccc(cc1)C
Properties
Complexity:
435
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.119g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
368.451g/mol
Monoisotopic Mass:
368.119g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
88.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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