AC1MX0GW structure

AC1MX0GW

7-(2-methylbutan-2-yl)-3-propyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Also Known As: 11-(2-Methylbutan-2-yl)-4-propyl-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-3-one|7-(1,1-Dimethyl-propyl)-2-mercapto-3-propyl-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one|11-(2-methylbutan-2-yl)-4-propyl-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|7-(2-methylbutan-2-yl)-3-propyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one|2-Mercapto-7-(tert-pentyl)-3-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3h)-one|11-(2-methylbutan-2-yl)-4-propyl-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0?,?]trideca-1(9),2(7),5-trien-3-one|7-(1,1-dimethylpropyl)-3-propyl-2-thioxo-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one

CAS: 736162-70-2
Molecular Formula C18H26N2OS2
Molecular Weight 350.14865 g/mol
LogP 5.07169
Topological Polar Surface Area 37.79 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 350.14865
Monoisotopic Mass 350.14865
Heavy Atoms 23
Complexity 841.04926

Chemical Identifiers

CAS Number 736162-70-2
SMILES CCCN1C(=O)C2=C(NC1=S)SC3=C2CCC(C3)C(C)(C)CC

Product Overview

AC1MX0GW (CAS 736162-70-2), with molecular formula C18H26N2OS2 and molecular weight 350.14865 g/mol. IUPAC: 7-(2-methylbutan-2-yl)-3-propyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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