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331847-89-3 | N-(4-acetylphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CAS No: 331847-89-3 Catalog No: AG00IVCH MDL No:MFCD01214482
Product Description
Catalog Number:
AG00IVCH
Chemical Name:
N-(4-acetylphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CAS Number:
331847-89-3
Molecular Formula:
C19H15ClN2O3
Molecular Weight:
354.7870
MDL Number:
MFCD01214482
IUPAC Name:
N-(4-acetylphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C19H15ClN2O3/c1-11(23)13-7-9-14(10-8-13)21-19(24)17-12(2)25-22-18(17)15-5-3-4-6-16(15)20/h3-10H,1-2H3,(H,21,24)
InChI Key:
CVXHLQDXLNXIEV-UHFFFAOYSA-N
SMILES:
O=C(c1c(C)onc1c1ccccc1Cl)Nc1ccc(cc1)C(=O)C
Properties
Complexity:
493
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.077g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
354.79g/mol
Monoisotopic Mass:
354.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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