200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 930396-26-2
930396-26-2 | 5-methyl-9-(propan-2-yl)-[1,2,4]triazolo[4,3-a]quinoline-1-thiol
CAS No: 930396-26-2 Catalog No: AG019QBU MDL No:MFCD09702311
Product Description
Catalog Number:
AG019QBU
Chemical Name:
5-methyl-9-(propan-2-yl)-[1,2,4]triazolo[4,3-a]quinoline-1-thiol
CAS Number:
930396-26-2
Molecular Formula:
C14H15N3S
Molecular Weight:
257.3540
MDL Number:
MFCD09702311
IUPAC Name:
5-methyl-9-propan-2-yl-2H-[1,2,4]triazolo[4,3-a]quinoline-1-thione
InChI:
InChI=1S/C14H15N3S/c1-8(2)10-5-4-6-11-9(3)7-12-15-16-14(18)17(12)13(10)11/h4-8H,1-3H3,(H,16,18)
InChI Key:
DTSIVOSTOLOSEV-UHFFFAOYSA-N
SMILES:
CC(c1cccc2c1n1c(S)nnc1cc2C)C
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.355g/mol
Monoisotopic Mass:
257.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.