3-Methyl-5,6-dihydrofuro[2,3-d]pyrimidine-2,4(1h,3h)-dione
Basic information
- CAS
21004-27-3- Standard SMILES
Cn1c(=O)[nH]c2c(c1=O)CCO2- InChIKey
KXDKSDNTMQIDGB-UHFFFAOYSA-N- Molecular formula
- C7H8N2O3
- Average molar mass
- 168.15 g/mol
- Monoisotopic mass
- 168.05349212
Names & identifiers
- Preferred name
- 3-Methyl-5,6-dihydrofuro[2,3-d]pyrimidine-2,4(1h,3h)-dione
- IUPAC
- 3-methyl-5,6-dihydro-1H-furo[2,3-d]pyrimidine-2,4-dione
Names & synonyms
21004-27-33-methyl-5,6-dihydrofuro[2,3-d]pyrimidine-2,4(1h,3h)-dioneNSC112548MLS002706451DTXSID40296905Furo[2,3-d]pyrimidine-2,4(1H,3H)-dione,5,6-dihydro-3-methyl-NSC-112548SMR001573857DS-001468
Database identifiers
- CAS
21004-27-3- PubChem CID
- 270280
- DTXSID
DTXSID40296905
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 295
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Compound notes
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