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16078-38-9 | Quinoline, 1-benzoyl-1,2,3,4-tetrahydro-
CAS No: 16078-38-9 Catalog No: AG00IQ67 MDL No:MFCD00690209
Product Description
Catalog Number:
AG00IQ67
Chemical Name:
Quinoline, 1-benzoyl-1,2,3,4-tetrahydro-
CAS Number:
16078-38-9
Molecular Formula:
C16H15NO
Molecular Weight:
237.2964
MDL Number:
MFCD00690209
IUPAC Name:
3,4-dihydro-2H-quinolin-1-yl(phenyl)methanone
InChI:
InChI=1S/C16H15NO/c18-16(14-8-2-1-3-9-14)17-12-6-10-13-7-4-5-11-15(13)17/h1-5,7-9,11H,6,10,12H2
InChI Key:
CEBQABUYWIZVHQ-UHFFFAOYSA-N
SMILES:
O=C(N1CCCc2c1cccc2)c1ccccc1
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.115g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.302g/mol
Monoisotopic Mass:
237.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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 |
| Synthesis and SAR of cis-1-benzoyl-1,2,3,4-tetrahydroquinoline ligands for control of gene expression in ecdysone responsive systems. | Bioorganic & medicinal chemistry letters 20030602 |
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