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832694-13-0 | Thieno[3,2-c]pyridine-7-propanamide, 4-amino-N-methyl-3-phenyl-
CAS No: 832694-13-0 Catalog No: AG004TUV MDL No:
Product Description
Catalog Number:
AG004TUV
Chemical Name:
Thieno[3,2-c]pyridine-7-propanamide, 4-amino-N-methyl-3-phenyl-
CAS Number:
832694-13-0
Molecular Formula:
C17H17N3OS
Molecular Weight:
311.4014
IUPAC Name:
3-(4-amino-3-phenylthieno[3,2-c]pyridin-7-yl)-N-methylpropanamide
InChI:
InChI=1S/C17H17N3OS/c1-19-14(21)8-7-12-9-20-17(18)15-13(10-22-16(12)15)11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H2,18,20)(H,19,21)
InChI Key:
MBKJEUHLGPAUPE-UHFFFAOYSA-N
SMILES:
CNC(=O)CCc1cnc(c2c1scc2c1ccccc1)N
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.109g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
311.403g/mol
Monoisotopic Mass:
311.109g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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