Ethyl 4-amino-5-methylthieno[3,4-d]pyrimidine-7-carboxylate
Basic information
- CAS
85092-76-8- Standard SMILES
CCOC(=O)c1sc(C)c2c(N)ncnc12- InChIKey
IXKPMGNYLQHYDH-UHFFFAOYSA-N- Molecular formula
- C10H11N3O2S
- Average molar mass
- 237.28 g/mol
- Monoisotopic mass
- 237.05719778
Names & identifiers
- Preferred name
- Ethyl 4-amino-5-methylthieno[3,4-d]pyrimidine-7-carboxylate
- IUPAC
- ethyl 4-amino-5-methylthieno[3,4-d]pyrimidine-7-carboxylate
Names & synonyms
DTXSID001188289Ethyl 4-amino-5-methylthieno[3,4-d]pyrimidine-7-carboxylate85092-76-8
Database identifiers
- CAS
85092-76-8- PubChem CID
- 15565697
- DTXSID
DTXSID001188289
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 277
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Compound notes
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