1,1'-Dihydropyrimidine-1,3(2h,4h)-diylbis[8-(3-octylthiiran-2-yl)octan-1-one] structure

1,1'-Dihydropyrimidine-1,3(2h,4h)-diylbis[8-(3-octylthiiran-2-yl)octan-1-one]

8-(3-octylthiiran-2-yl)-1-[3-[8-(3-octylthiiran-2-yl)octanoyl]-1,3-diazinan-1-yl]octan-1-one

Also Known As: KST-1B4909|1,1'-dihydropyrimidine-1,3(2h,4h)-diylbis[8-(3-octylthiiran-2-yl)octan-1-one]|1,1'-(1,3-Diazinane-1,3-diyl)bis[8-(3-octylthiiran-2-yl)octan-1-one]|8-(3-octylthiiran-2-yl)-1-[3-[8-(3-octylthiiran-2-yl)octanoyl]-1,3-diazinan-1-yl]octan-1-one

CAS: 532-31-0
Molecular Formula C40H74N2O2S2
Molecular Weight 678.51917 g/mol
LogP 13.7
Topological Polar Surface Area 91.2 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 30
Exact Mass 678.51917
Monoisotopic Mass 678.51917
Heavy Atoms 46
Complexity 733.0

Chemical Identifiers

CAS Number 532-31-0
SMILES CCCCCCCCC1C(S1)CCCCCCCC(=O)N2CCCN(C2)C(=O)CCCCCCCC3C(S3)CCCCCCCC
InChIKey QRGLIZFNUZGDOY-UHFFFAOYSA-N

Product Overview

1,1'-Dihydropyrimidine-1,3(2h,4h)-diylbis[8-(3-octylthiiran-2-yl)octan-1-one] (CAS 532-31-0), with molecular formula C40H74N2O2S2 and molecular weight 678.51917 g/mol. IUPAC: 8-(3-octylthiiran-2-yl)-1-[3-[8-(3-octylthiiran-2-yl)octanoyl]-1,3-diazinan-1-yl]octan-1-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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1,1'-Dihydropyrimidine-1,3(2h,4h)-diylbis[8-(3-octylthiiran-2-yl)octan-1-one] is a custom synthesis product. We offer services from milligram to kilogram scale.

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