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
| 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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