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141648-21-7 | Acetamide, N,N'-(3-cyano-2,4-quinolinediyl)bis- (9CI)
CAS No: 141648-21-7 Catalog No: AG001GTV MDL No:
Product Description
Catalog Number:
AG001GTV
Chemical Name:
Acetamide, N,N'-(3-cyano-2,4-quinolinediyl)bis- (9CI)
CAS Number:
141648-21-7
Molecular Formula:
C14H12N4O2
Molecular Weight:
268.2707
IUPAC Name:
N-(2-acetamido-3-cyanoquinolin-4-yl)acetamide
InChI:
InChI=1S/C14H12N4O2/c1-8(19)16-13-10-5-3-4-6-12(10)18-14(11(13)7-15)17-9(2)20/h3-6H,1-2H3,(H2,16,17,18,19,20)
InChI Key:
WAKUCHBBQLWQSS-UHFFFAOYSA-N
SMILES:
N#Cc1c(NC(=O)C)nc2c(c1NC(=O)C)cccc2
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.096g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
268.276g/mol
Monoisotopic Mass:
268.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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