200,000+ products from a single source!
sales@angenechem.com
23018-37-3 | [1]Benzothieno[2,3-g]isoquinoline, 5,11-dimethyl-, 2,6,6-trioxide
CAS No: 23018-37-3 Catalog No: AG002LVJ MDL No:
Product Description
Catalog Number:
AG002LVJ
Chemical Name:
[1]Benzothieno[2,3-g]isoquinoline, 5,11-dimethyl-, 2,6,6-trioxide
CAS Number:
23018-37-3
Molecular Formula:
C17H13NO3S
Molecular Weight:
311.3550
IUPAC Name:
5,11-dimethyl-2-oxido-[1]benzothiolo[2,3-g]isoquinolin-2-ium 6,6-dioxide
InChI:
InChI=1S/C17H13NO3S/c1-10-14-9-18(19)8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)22(17,20)21/h3-9H,1-2H3
InChI Key:
WEAOWHGLULLDBQ-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc2c(c1)c(C)c1c(c2C)S(=O)(=O)c2c1cccc2
NSC Number:
125059
Properties
Complexity:
543
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.062g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.355g/mol
Monoisotopic Mass:
311.062g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.