Benzyl9H-carbazole-9-carbodithioate
Product Information
Molecular Formula
C20H15NS2
Molecular Weight
333.4698
Description
Benzyl9H-carbazole-9-carbodithioate exerts its therapeutic potential by virtuously inhibiting key enzymes aptly implicated in the relentless advancement of certain malignant neoplasms. Remarkably, Benzyl9H-carbazole-9-carbodithioate unveils an extraordinary amalgamation of potent anti-inflammatory and antioxidative attributes, thus remaining an invaluable constituent in the realm of meticulous pharmaceutical advancements.
Synonyms
9H-Carbazole-9-carbodithioic acid, phenylmethyl ester; BENZYL CARBAZOLE-9-CARBODITHIOATE; 9H-Carbazole-9-carbodithioic acid benzyl ester
IUPAC Name
benzyl carbazole-9-carbodithioate
SMILES
C1=CC=C(C=C1)CSC(=S)N2C3=CC=CC=C3C4=CC=CC=C42
InChI
InChI=1S/C20H15NS2/c22-20(23-14-15-8-2-1-3-9-15)21-18-12-6-4-10-16(18)17-11-5-7-13-19(17)21/h1-13H,14H2
InChI Key
DFLKGYBBYMCANE-UHFFFAOYSA-N
Purity
97%
Computed Properties
XLogP3
6.3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
3
Exact Mass
333.06459183 g/mol
Monoisotopic Mass
333.06459183 g/mol
Topological Polar Surface Area
62.3Ų
Heavy Atom Count
23
Formal Charge
0
Complexity
396
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
