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2,4(1H,3H)-Pyrimidinedione, 1,3-bis(2-((2-methylpropyl)sulfinyl)ethyl)-6-methyl-5-(2-((2-methylpropyl)sulfinyl)ethoxy)-

HCID 3075409
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Basic information

CAS
180274-08-2
Standard SMILES
Cc1c(OCCS(=O)CC(C)C)c(=O)n(CCS(=O)CC(C)C)c(=O)n1CCS(=O)CC(C)C
InChIKey
LUJVTYFNHWTTHV-UHFFFAOYSA-N
Molecular formula
C23H42N2O6S3
Average molar mass
538.8 g/mol
Monoisotopic mass
538.22050058

Names & identifiers

Preferred name
2,4(1H,3H)-Pyrimidinedione, 1,3-bis(2-((2-methylpropyl)sulfinyl)ethyl)-6-methyl-5-(2-((2-methylpropyl)sulfinyl)ethoxy)-
IUPAC
6-methyl-5-[2-(2-methylpropylsulfinyl)ethoxy]-1,3-bis[2-(2-methylpropylsulfinyl)ethyl]pyrimidine-2,4-dione
English name
1,3-Bis(isobutylsulfinylethyl)-5-isobutylsulfinylethoxy-6-methyluracil
Molecular weight
0

Names & synonyms

180274-08-21,3-Bis(isobutylsulfinylethyl)-5-isobutylsulfinylethoxy-6-methyluracil2,4(1H,3H)-Pyrimidinedione, 1,3-bis(2-((2-methylpropyl)sulfinyl)ethyl)-6-methyl-5-(2-((2-methylpropyl)sulfinyl)ethoxy)-RefChem:245277DTXSID909393156-Methyl-5-[2-(2-methylpropane-1-sulfinyl)ethoxy]-1,3-bis[2-(2-methylpropane-1-sulfinyl)ethyl]pyrimidine-2,4(1H,3H)-dione

Database identifiers

CAS
180274-08-2
PubChem CID
3075409
DTXSID
DTXSID90939315

Properties

Computed structural properties

XLogP
1
Topological polar surface area
159 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
16
Heavy atoms
34
Formal charge
0
Complexity
811

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