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16060-68-7 | 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-(2-thiazolyl)-
CAS No: 16060-68-7 Catalog No: AG001S2Y MDL No:
Product Description
Catalog Number:
AG001S2Y
Chemical Name:
1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-(2-thiazolyl)-
CAS Number:
16060-68-7
Molecular Formula:
C15H8N2O2S
Molecular Weight:
280.3012
IUPAC Name:
2-(1,3-thiazol-2-yl)benzo[de]isoquinoline-1,3-dione
InChI:
InChI=1S/C15H8N2O2S/c18-13-10-5-1-3-9-4-2-6-11(12(9)10)14(19)17(13)15-16-7-8-20-15/h1-8H
InChI Key:
XEDNDDVVAADJJG-UHFFFAOYSA-N
SMILES:
O=c1c2cccc3c2c(c(=O)n1c1nccs1)ccc3
UNII:
AFO0YI61JJ
NSC Number:
73226
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.031g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.301g/mol
Monoisotopic Mass:
280.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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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