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Home > Pyridines > 860650-37-9
860650-37-9 | 7-(2H-1,3-benzodioxol-5-yl)-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CAS No: 860650-37-9 Catalog No: AG00IPWS MDL No:MFCD03787394
Product Description
Catalog Number:
AG00IPWS
Chemical Name:
7-(2H-1,3-benzodioxol-5-yl)-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CAS Number:
860650-37-9
Molecular Formula:
C18H10N4O3
Molecular Weight:
330.2970
MDL Number:
MFCD03787394
IUPAC Name:
7-(1,3-benzodioxol-5-yl)-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
InChI:
InChI=1S/C18H10N4O3/c19-9-13-12(11-3-4-14-16(8-11)25-10-24-14)5-6-22-18(13)20-17(21-22)15-2-1-7-23-15/h1-8H,10H2
InChI Key:
SEKTYBJRWVIIAJ-UHFFFAOYSA-N
SMILES:
N#Cc1c(ccn2c1nc(n2)c1ccco1)c1ccc2c(c1)OCO2
Properties
Complexity:
552
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.075g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.303g/mol
Monoisotopic Mass:
330.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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