200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 917747-83-2
917747-83-2 | 7,9-Dimethyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
CAS No: 917747-83-2 Catalog No: AG01EZ5X MDL No:
Product Description
Catalog Number:
AG01EZ5X
Chemical Name:
7,9-Dimethyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
CAS Number:
917747-83-2
Molecular Formula:
C11H10N4S
Molecular Weight:
230.2889
IUPAC Name:
7,9-dimethyl-2,5-dihydro-[1,2,4]triazino[5,6-b]indole-3-thione
InChI:
InChI=1S/C11H10N4S/c1-5-3-6(2)8-7(4-5)12-10-9(8)14-15-11(16)13-10/h3-4H,1-2H3,(H2,12,13,15,16)
InChI Key:
NKLOOHRELRMKAI-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c2c(c1)[nH]c1c2nnc(n1)S
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.063g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.289g/mol
Monoisotopic Mass:
230.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.