4-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-yl carbamimidothioate
Basic information
- CAS
5118-01-4- Standard SMILES
Cc1nc(SC(=N)N)nc2c1CCO2- InChIKey
MZUUABVJSFQJSF-UHFFFAOYSA-N- Molecular formula
- C8H10N4OS
- Average molar mass
- 210.26 g/mol
- Monoisotopic mass
- 210.05753213
Names & identifiers
- Preferred name
- 4-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-yl carbamimidothioate
- IUPAC
- (4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-yl) carbamimidothioate
Names & synonyms
787500-81-64-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-yl carbamimidothioate5118-01-4DTXSID509654534-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-ylcarbamimidothioate
Database identifiers
- CAS
5118-01-4- PubChem CID
- 419161
- DTXSID
DTXSID50965453
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 237
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Compound notes
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