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116538-96-6

116538-96-6 | Thieno[3,2-b]pyridine-6-carbonitrile, 3-amino-

CAS No: 116538-96-6 Catalog No: AG000CQ1 MDL No:MFCD19690009

Product Description

Catalog Number:
AG000CQ1
Chemical Name:
Thieno[3,2-b]pyridine-6-carbonitrile, 3-amino-
CAS Number:
116538-96-6
Molecular Formula:
C8H5N3S
Molecular Weight:
175.2104
MDL Number:
MFCD19690009
IUPAC Name:
3-aminothieno[3,2-b]pyridine-6-carbonitrile
InChI:
InChI=1S/C8H5N3S/c9-2-5-1-7-8(11-3-5)6(10)4-12-7/h1,3-4H,10H2
InChI Key:
NDMHPSBWIFCVTR-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1)scc2N

Properties

Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
175.209g/mol
Monoisotopic Mass:
175.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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