AC1M0A7R structure

AC1M0A7R

5-benzylsulfanyl-3-[(2,4-dichlorophenyl)methylsulfanyl]-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene

Also Known As: 2-(benzylsulfanyl)-4-[(2,4-dichlorobenzyl)sulfanyl]-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine|2-(benzylthio)-4-((2,4-dichlorobenzyl)thio)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine

CAS: 586989-87-9
Molecular Formula C25H22Cl2N2OS3
Molecular Weight 532.02716 g/mol
LogP 8.434
Topological Polar Surface Area 35.01 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 532.02716
Monoisotopic Mass 532.02716
Heavy Atoms 33
Complexity 1308.2535

Chemical Identifiers

CAS Number 586989-87-9
SMILES CC1(CC2=C(CO1)SC3=C2C(=NC(=N3)SCC4=CC=CC=C4)SCC5=C(C=C(C=C5)Cl)Cl)C

Product Overview

AC1M0A7R (CAS 586989-87-9), with molecular formula C25H22Cl2N2OS3 and molecular weight 532.02716 g/mol. IUPAC: 5-benzylsulfanyl-3-[(2,4-dichlorophenyl)methylsulfanyl]-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene.

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