200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 332110-24-4
332110-24-4 | 2-{5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl}acetonitrile
CAS No: 332110-24-4 Catalog No: AG00ITD2 MDL No:MFCD00170777
Product Description
Catalog Number:
AG00ITD2
Chemical Name:
2-{5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl}acetonitrile
CAS Number:
332110-24-4
Molecular Formula:
C11H7N5S
Molecular Weight:
241.2718
MDL Number:
MFCD00170777
IUPAC Name:
2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetonitrile
InChI:
InChI=1S/C11H7N5S/c12-5-6-17-11-14-10-9(15-16-11)7-3-1-2-4-8(7)13-10/h1-4H,6H2,(H,13,14,16)
InChI Key:
KYTYZFXPOYQWQP-UHFFFAOYSA-N
SMILES:
N#CCSc1nnc2c(n1)[nH]c1c2cccc1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.042g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.272g/mol
Monoisotopic Mass:
241.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.