200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 918949-03-8
918949-03-8 | 1-Isoquinolinecarboxamide, 4-cyano-N-cyclohexyl-
CAS No: 918949-03-8 Catalog No: AG006A3H MDL No:
Product Description
Catalog Number:
AG006A3H
Chemical Name:
1-Isoquinolinecarboxamide, 4-cyano-N-cyclohexyl-
CAS Number:
918949-03-8
Molecular Formula:
C17H17N3O
Molecular Weight:
279.3364
IUPAC Name:
4-cyano-N-cyclohexylisoquinoline-1-carboxamide
InChI:
InChI=1S/C17H17N3O/c18-10-12-11-19-16(15-9-5-4-8-14(12)15)17(21)20-13-6-2-1-3-7-13/h4-5,8-9,11,13H,1-3,6-7H2,(H,20,21)
InChI Key:
LYWYYZGXFYXVGE-UHFFFAOYSA-N
SMILES:
N#Cc1cnc(c2c1cccc2)C(=O)NC1CCCCC1
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.137g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.343g/mol
Monoisotopic Mass:
279.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.