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23436-62-6 | Butanamide, N-[4-(4-methoxyphenyl)-2-thiazolyl]-3-oxo-
CAS No: 23436-62-6 Catalog No: AG002N7L MDL No:
Product Description
Catalog Number:
AG002N7L
Chemical Name:
Butanamide, N-[4-(4-methoxyphenyl)-2-thiazolyl]-3-oxo-
CAS Number:
23436-62-6
Molecular Formula:
C14H14N2O3S
Molecular Weight:
290.3376
IUPAC Name:
N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-oxobutanamide
InChI:
InChI=1S/C14H14N2O3S/c1-9(17)7-13(18)16-14-15-12(8-20-14)10-3-5-11(19-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,15,16,18)
InChI Key:
MDFYWEIVVYIYEM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1csc(n1)NC(=O)CC(=O)C
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.073g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.337g/mol
Monoisotopic Mass:
290.073g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
96.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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