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537677-89-7 | Thiazolidine, 2-(4-methylphenyl)-3-[(2-oxo-2H-1-benzopyran-3-yl)carbonyl]- (9CI)
CAS No: 537677-89-7 Catalog No: AG00E88F MDL No:
Product Description
Catalog Number:
AG00E88F
Chemical Name:
Thiazolidine, 2-(4-methylphenyl)-3-[(2-oxo-2H-1-benzopyran-3-yl)carbonyl]- (9CI)
CAS Number:
537677-89-7
IUPAC Name:
3-[2-(4-methylphenyl)-1,3-thiazolidine-3-carbonyl]chromen-2-one
InChI:
InChI=1S/C20H17NO3S/c1-13-6-8-14(9-7-13)19-21(10-11-25-19)18(22)16-12-15-4-2-3-5-17(15)24-20(16)23/h2-9,12,19H,10-11H2,1H3
InChI Key:
KIUIBTNIQKQCNX-UHFFFAOYSA-N
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.093g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.42g/mol
Monoisotopic Mass:
351.093g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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