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6-(4,4-dimethylcyclohexyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one

HCID 118024077
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1nc2sc(C3CCC(C)(C)CC3)cc2c(=O)[nH]1
InChIKey
DFJFXYSQTSMDJE-UHFFFAOYSA-N
Molecular formula
C15H20N2OS
Average molar mass
276.4 g/mol

Names & identifiers

Preferred name
6-(4,4-dimethylcyclohexyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one
IUPAC
6-(4,4-dimethylcyclohexyl)-2-methyl-3H-thieno[2,3-d]pyrimidin-4-one

Names & synonyms

SCHEMBL16653487DFJFXYSQTSMDJE-UHFFFAOYSA-N6-(4,4-dimethylcyclohexyl)-2-methylthieno[2,3-d]pyrimidin-4(3H)-one

Database identifiers

PubChem CID
118024077

Properties

Computed structural propertiesFilling in

XLogP
3.6
Topological polar surface area
69.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Formal charge
0
Complexity
408

Related reactions

1 records
New reaction record
HRID 2171774 reaction equation
HRID 2171774As reactantuspto-grants-2015_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes