200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 588673-17-0
588673-17-0 | 4-methyl-5-[2-(4-methylphenyl)quinolin-4-yl]-4H-1,2,4-triazole-3-thiol
CAS No: 588673-17-0 Catalog No: AG019P28 MDL No:MFCD03943432
Product Description
Catalog Number:
AG019P28
Chemical Name:
4-methyl-5-[2-(4-methylphenyl)quinolin-4-yl]-4H-1,2,4-triazole-3-thiol
CAS Number:
588673-17-0
Molecular Formula:
C19H16N4S
Molecular Weight:
332.4221
MDL Number:
MFCD03943432
IUPAC Name:
4-methyl-3-[2-(4-methylphenyl)quinolin-4-yl]-1H-1,2,4-triazole-5-thione
InChI:
InChI=1S/C19H16N4S/c1-12-7-9-13(10-8-12)17-11-15(18-21-22-19(24)23(18)2)14-5-3-4-6-16(14)20-17/h3-11H,1-2H3,(H,22,24)
InChI Key:
BGZSWNSEDYLNKW-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1nc2ccccc2c(c1)c1nnc(n1C)S
Properties
Complexity:
512
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.11g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.425g/mol
Monoisotopic Mass:
332.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.