Botiacrine ethanesulfonate

S-[2-[(4-methoxyphenyl)methyl-methylamino]ethyl] 9,9-dimethylacridine-10-carbothioate

Also Known As: Botiacrine ethanesulfonate|Mo 1315|10(9H)-Acridinecarbothioic acid, 9,9-dimethyl-, S-(2-(((4-methoxyphenyl)methyl)methylamino)ethyl) ester|-[2-[methyl-methyl-amino]ethylsulfanyl]methanone|-[2-[ methyl-methyl-amino]ethylsulfanyl]methanone|S-(2-((4-Methoxybenzyl)methylamino)ethyl) 9,9-dimethyl-10(9H)-acridinecarbothioate|S-[2-[(4-methoxyphenyl)methyl-methylamino]ethyl] 9,9-dimethylacridine-10-carbothioate|s-{2-[(4-methoxybenzyl)(methyl)amino]ethyl} 9,9-dimethylacridine-10(9h)-carbothioate|S-(2-{[(4-Methoxyphenyl)methyl](methyl)amino}ethyl) 9,9-dimethylacridine-10(9H)-carbothioate

Molecular Formula	C27H30N2O2S
Molecular Weight	446.2028 g/mol
LogP	6.2
Topological Polar Surface Area	58.1 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	446.2028
Monoisotopic Mass	446.2028
Heavy Atoms	32
Complexity	593.0

Chemical Identifiers

CAS Number	4602-50-0
SMILES	CC1(C2=CC=CC=C2N(C3=CC=CC=C31)C(=O)SCCN(C)CC4=CC=C(C=C4)OC)C
InChIKey	ZEBKUFOXMUTVNE-UHFFFAOYSA-N