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Home > Pyridines > 1369966-94-8
1369966-94-8 | Acetamide, N-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-
CAS No: 1369966-94-8 Catalog No: AG0012NH MDL No:MFCD24620511
Product Description
Catalog Number:
AG0012NH
Chemical Name:
Acetamide, N-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-
CAS Number:
1369966-94-8
Molecular Formula:
C9H12N2OS
Molecular Weight:
196.2694
MDL Number:
MFCD24620511
IUPAC Name:
N-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide
InChI:
InChI=1S/C9H12N2OS/c1-6(12)11-9-4-7-2-3-10-5-8(7)13-9/h4,10H,2-3,5H2,1H3,(H,11,12)
InChI Key:
CESREUUHJVXJNZ-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc2c(s1)CNCC2
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.268g/mol
Monoisotopic Mass:
196.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| Synthesis, biological evaluation, and structure-activity relationships of a novel class of apurinic/apyrimidinic endonuclease 1 inhibitors. | Journal of medicinal chemistry 20120412 |
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