Basic information
- CAS
101667-99-6- Standard SMILES
CCOC(=O)c1sc2ncnc(OC)c2c1C- InChIKey
BJCRYHMRNPOVKG-UHFFFAOYSA-N- Molecular formula
- C11H12N2O3S
- Average molar mass
- 252.29 g/mol
- Monoisotopic mass
- 252.05686342
Names & identifiers
- Preferred name
- Ethyl 4-methoxy-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
- IUPAC
- ethyl 4-methoxy-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Names & synonyms
ethyl 4-methoxy-5-methylthieno[2,3-d]pyrimidine-6-carboxylateMLS000039232101667-99-6CHEMBL1575992SCHEMBL23630827DTXSID401142627HMS2313N23HMS5091G14STK830891AKOS001489575CCG-125269SMR000039286
Show more names
Thieno[2,3-d]pyrimidine-6-carboxylic acid, 4-methoxy-5-methyl-, ethyl ester
Database identifiers
- CAS
101667-99-6- PubChem CID
- 658409
- DTXSID
DTXSID401142627- ChEMBL
CHEMBL1575992
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 89.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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