2-Imino-6-methyl-4-(thiomorpholin-4-yl)pyrimidin-1(2H)-ol

HCID 19085624

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Basic information

CAS: 60928-36-1
Standard SMILES: Cc1cc(N2CCSCC2)nc(=N)n1O
InChIKey: NZKFTIRWVNBKGT-UHFFFAOYSA-N
Molecular formula: C9H14N4OS
Average molar mass: 226.3 g/mol
Monoisotopic mass: 226.08883226

Names & identifiers

Preferred name: 2-Imino-6-methyl-4-(thiomorpholin-4-yl)pyrimidin-1(2H)-ol
IUPAC: 1-hydroxy-6-methyl-4-thiomorpholin-4-ylpyrimidin-2-imine

Names & synonyms

60928-36-1SCHEMBL8688404DTXSID20597922NZKFTIRWVNBKGT-UHFFFAOYSA-N2-Imino-6-methyl-4-(thiomorpholin-4-yl)pyrimidin-1(2H)-ol1,2-DIHYDRO-2-IMINO-6-METHYL-4-THIOMORPHOLINO-1-PYRIMIDINOL

Database identifiers

CAS: 60928-36-1
PubChem CID: 19085624
DTXSID: DTXSID20597922

Properties

Computed structural properties

XLogP: 1.7
Topological polar surface area: 88.2 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 333

Related reactions

1 records

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HRID 1282910As productuspto-grants-1976_08

Compound notes

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