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Home > Quinoline > 692732-82-4
692732-82-4 | N-(4-acetylphenyl)-1,2,3,4-tetrahydroisoquinoline-2-carboxamide
CAS No: 692732-82-4 Catalog No: AG00IVOK MDL No:MFCD03102637
Product Description
Catalog Number:
AG00IVOK
Chemical Name:
N-(4-acetylphenyl)-1,2,3,4-tetrahydroisoquinoline-2-carboxamide
CAS Number:
692732-82-4
Molecular Formula:
C18H18N2O2
Molecular Weight:
294.3477
MDL Number:
MFCD03102637
IUPAC Name:
N-(4-acetylphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
InChI:
InChI=1S/C18H18N2O2/c1-13(21)14-6-8-17(9-7-14)19-18(22)20-11-10-15-4-2-3-5-16(15)12-20/h2-9H,10-12H2,1H3,(H,19,22)
InChI Key:
SURYOOCJKPJCFJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c(C1)cccc2)Nc1ccc(cc1)C(=O)C
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.354g/mol
Monoisotopic Mass:
294.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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