Olpimedone
Basic information
- CAS
108936-27-2- Standard SMILES
CC1CC(=O)N2CCSC2=N1- InChIKey
SFRKFKTUSAUZMI-UHFFFAOYSA-N- Molecular formula
- C7H10N2OS
- Average molar mass
- 170.23 g/mol
- Monoisotopic mass
- 170.05138412
Names & identifiers
- Preferred name
- Olpimedone
- IUPAC
- 7-methyl-2,3,6,7-tetrahydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
- English name
- Olpimedone
- Molecular formula
- C7H10N2OS
- Molecular weight
- 170.23
Names & synonyms
Olpimedone39567-20-9OlpimedonaOlpimedonumMG3LH077H25H-Thiazolo(3,2-a)pyrimidin-5-one, 2,3,6,7-tetrahydro-7-methyl-RefChem:1093883Olpimedone [INN]7-methyl-2,3,6,7-tetrahydro-[1,3]thiazolo[3,2-a]pyrimidin-5-oneOlpimedone, (+)-Olpimedone, (-)-51EB9T1Y1X
Show more names
5XGM37G868Olpimedonum [Latin]Olpimedona [Spanish]5H-Thiazolo(3,2-a)pyrimidin-5-one, 2,3,6,7-tetrahydro-7-methyl-, (+)-5H-Thiazolo(3,2-a)pyrimidin-5-one, 2,3,6,7-tetrahydro-7-methyl-, (-)-108936-27-2746565-68-4UNII-MG3LH077H2
Database identifiers
- CAS
108936-27-2、39567-20-9、746565-68-4- PubChem CID
- 65974
- DTXSID
DTXSID90865963- ChEMBL
CHEMBL2105310- UNII
- 51EB9T1Y1X、5XGM37G868、MG3LH077H2
- Nikkaji
- J2.368.057B
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 58 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 226
Physicochemical properties
- Boiling point
- 277.1 · 277.1±23.0 °C(Predicted)
- Density
- 1.48 · 1.48±0.1 g/cm3(Predicted)
- pka
- 3.06 · 3.06±0.40(Predicted)
- FDA UNII
- 3 LH077H2 · MG3LH077H2
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Related reactions
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Compound notes
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