200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 663181-77-9
663181-77-9 | 4-(2-methoxyethyl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
CAS No: 663181-77-9 Catalog No: AG019HDD MDL No:MFCD03414048
Product Description
Catalog Number:
AG019HDD
Chemical Name:
4-(2-methoxyethyl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
CAS Number:
663181-77-9
Molecular Formula:
C10H12N4OS
Molecular Weight:
236.2935
MDL Number:
MFCD03414048
IUPAC Name:
4-(2-methoxyethyl)-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione
InChI:
InChI=1S/C10H12N4OS/c1-15-7-6-14-9(12-13-10(14)16)8-2-4-11-5-3-8/h2-5H,6-7H2,1H3,(H,13,16)
InChI Key:
YEEXLQYXOMMAAJ-UHFFFAOYSA-N
SMILES:
COCCn1c(S)nnc1c1ccncc1
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.073g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.293g/mol
Monoisotopic Mass:
236.073g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.