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138299-97-5 | Butanamide, N-acetyl-N-(5,6,7,8-tetrahydrothieno[2,3-b]quinolin-4-yl)-
CAS No: 138299-97-5 Catalog No: AG0018GY MDL No:
Product Description
Catalog Number:
AG0018GY
Chemical Name:
Butanamide, N-acetyl-N-(5,6,7,8-tetrahydrothieno[2,3-b]quinolin-4-yl)-
CAS Number:
138299-97-5
Molecular Formula:
C17H20N2O2S
Molecular Weight:
316.4179
IUPAC Name:
N-acetyl-N-(5,6,7,8-tetrahydrothieno[2,3-b]quinolin-4-yl)butanamide
InChI:
InChI=1S/C17H20N2O2S/c1-3-6-15(21)19(11(2)20)16-12-7-4-5-8-14(12)18-17-13(16)9-10-22-17/h9-10H,3-8H2,1-2H3
InChI Key:
IVXHQLDRYHUFIR-UHFFFAOYSA-N
SMILES:
CCCC(=O)N(c1c2CCCCc2nc2c1ccs2)C(=O)C
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.125g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.419g/mol
Monoisotopic Mass:
316.125g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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