200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 685108-56-9
685108-56-9 | 7-(2H-1,3-benzodioxol-5-yl)-2-pentyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CAS No: 685108-56-9 Catalog No: AG00IPWU MDL No:MFCD03617584
Product Description
Catalog Number:
AG00IPWU
Chemical Name:
7-(2H-1,3-benzodioxol-5-yl)-2-pentyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CAS Number:
685108-56-9
Molecular Formula:
C19H18N4O2
Molecular Weight:
334.3718
MDL Number:
MFCD03617584
IUPAC Name:
7-(1,3-benzodioxol-5-yl)-2-pentyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
InChI:
InChI=1S/C19H18N4O2/c1-2-3-4-5-18-21-19-15(11-20)14(8-9-23(19)22-18)13-6-7-16-17(10-13)25-12-24-16/h6-10H,2-5,12H2,1H3
InChI Key:
ISKGFACRZUYOKR-UHFFFAOYSA-N
SMILES:
CCCCCc1nn2c(n1)c(C#N)c(cc2)c1ccc2c(c1)OCO2
Properties
Complexity:
507
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.143g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.379g/mol
Monoisotopic Mass:
334.143g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.