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1358044-81-1 | N-(4-chloro-2-methylphenyl)-5-methyl-3-(pyridin-3-yl)-1,2-oxazole-4-carboxamide
CAS No: 1358044-81-1 Catalog No: AG01B8NY MDL No:MFCD27100031
Product Description
Catalog Number:
AG01B8NY
Chemical Name:
N-(4-chloro-2-methylphenyl)-5-methyl-3-(pyridin-3-yl)-1,2-oxazole-4-carboxamide
CAS Number:
1358044-81-1
Molecular Formula:
C17H14ClN3O2
Molecular Weight:
327.7650
MDL Number:
MFCD27100031
IUPAC Name:
N-(4-chloro-2-methylphenyl)-5-methyl-3-pyridin-3-yl-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C17H14ClN3O2/c1-10-8-13(18)5-6-14(10)20-17(22)15-11(2)23-21-16(15)12-4-3-7-19-9-12/h3-9H,1-2H3,(H,20,22)
InChI Key:
SFCXPCDGSQHUFA-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C)NC(=O)c1c(C)onc1c1cccnc1
Properties
Complexity:
423
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.077g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.768g/mol
Monoisotopic Mass:
327.077g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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