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192718-21-1 | Naphtho[2,3-d]thiazole-4,9-dione, 2-(2-thienyl)-
CAS No: 192718-21-1 Catalog No: AG002G8U MDL No:
Product Description
Catalog Number:
AG002G8U
Chemical Name:
Naphtho[2,3-d]thiazole-4,9-dione, 2-(2-thienyl)-
CAS Number:
192718-21-1
Molecular Formula:
C15H7NO2S2
Molecular Weight:
297.3516
IUPAC Name:
2-thiophen-2-ylbenzo[f][1,3]benzothiazole-4,9-dione
InChI:
InChI=1S/C15H7NO2S2/c17-12-8-4-1-2-5-9(8)13(18)14-11(12)16-15(20-14)10-6-3-7-19-10/h1-7H
InChI Key:
ZGHCUFXULYADMS-UHFFFAOYSA-N
SMILES:
O=C1c2sc(nc2C(=O)c2c1cccc2)c1cccs1
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.992g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.346g/mol
Monoisotopic Mass:
296.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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