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88594-28-9 | Imidazo[1,2-a]pyridine-3-acetonitrile, 2-(5-chloro-2-thienyl)-6-methyl-
CAS No: 88594-28-9 Catalog No: AG004BM2 MDL No:
Product Description
Catalog Number:
AG004BM2
Chemical Name:
Imidazo[1,2-a]pyridine-3-acetonitrile, 2-(5-chloro-2-thienyl)-6-methyl-
CAS Number:
88594-28-9
Molecular Formula:
C14H10ClN3S
Molecular Weight:
287.7673
IUPAC Name:
2-[2-(5-chlorothiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
InChI:
InChI=1S/C14H10ClN3S/c1-9-2-5-13-17-14(11-3-4-12(15)19-11)10(6-7-16)18(13)8-9/h2-5,8H,6H2,1H3
InChI Key:
OXSSYPPKLZCGID-UHFFFAOYSA-N
SMILES:
N#CCc1c(nc2n1cc(C)cc2)c1ccc(s1)Cl
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.028g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.765g/mol
Monoisotopic Mass:
287.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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