200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 881853-68-5
881853-68-5 | Carbamodithioic acid, (1H-indol-2-ylmethyl)-, methyl ester
CAS No: 881853-68-5 Catalog No: AG004EUX MDL No:
Product Description
Catalog Number:
AG004EUX
Chemical Name:
Carbamodithioic acid, (1H-indol-2-ylmethyl)-, methyl ester
CAS Number:
881853-68-5
Molecular Formula:
C11H12N2S2
Molecular Weight:
236.3564
IUPAC Name:
methyl N-(1H-indol-2-ylmethyl)carbamodithioate
InChI:
InChI=1S/C11H12N2S2/c1-15-11(14)12-7-9-6-8-4-2-3-5-10(8)13-9/h2-6,13H,7H2,1H3,(H,12,14)
InChI Key:
XXVHTDZCNVORLP-UHFFFAOYSA-N
SMILES:
CSC(=S)NCc1cc2c([nH]1)cccc2
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.044g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.351g/mol
Monoisotopic Mass:
236.044g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Metabolism and metabolites of dithiocarbamates in the plant pathogenic fungus Leptosphaeria maculans. | Journal of agricultural and food chemistry 20120815 |
| Design, synthesis, and evaluation of potential inhibitors of brassinin glucosyltransferase, a phytoalexin detoxifying enzyme from Sclerotinia sclerotiorum. | Bioorganic & medicinal chemistry 20070901 |
| Isobrassinin and its analogues: novel types of antiproliferative agents. | Bioorganic & medicinal chemistry letters 20061215 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.