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332157-16-1 | N-(3,5-dichlorophenyl)-2-(4-methoxyphenyl)-4-quinolinecarboxamide
CAS No: 332157-16-1 Catalog No: AG01D4T7 MDL No:MFCD01818730
Product Description
Catalog Number:
AG01D4T7
Chemical Name:
N-(3,5-dichlorophenyl)-2-(4-methoxyphenyl)-4-quinolinecarboxamide
CAS Number:
332157-16-1
Molecular Formula:
C23H16Cl2N2O2
Molecular Weight:
423.2913
MDL Number:
MFCD01818730
IUPAC Name:
N-(3,5-dichlorophenyl)-2-(4-methoxyphenyl)quinoline-4-carboxamide
InChI:
InChI=1S/C23H16Cl2N2O2/c1-29-18-8-6-14(7-9-18)22-13-20(19-4-2-3-5-21(19)27-22)23(28)26-17-11-15(24)10-16(25)12-17/h2-13H,1H3,(H,26,28)
InChI Key:
IZBMXOAQCSAWPJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1cc(Cl)cc(c1)Cl
NSC Number:
343551
Properties
Complexity:
545
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.059g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
423.293g/mol
Monoisotopic Mass:
422.059g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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