Basic information
- CAS
19572-10-2- Standard SMILES
CCOC(=O)c1cn(CC)c2nc(OC)ncc2c1=O- InChIKey
KDQDRZOROIKCCP-UHFFFAOYSA-N- Molecular formula
- C13H15N3O4
- Average molar mass
- 277.28 g/mol
- Monoisotopic mass
- 277.10625597
Names & identifiers
- Preferred name
- Ethyl 8-ethyl-5,8-dihydro-2-methoxy-5-oxopyrido(2,3-d)pyrimidine-6-carboxylate
- IUPAC
- ethyl 8-ethyl-2-methoxy-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate
- English name
- ethyl 8-ethyl-5,8-dihydro-2-methoxy-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate
- Molecular formula
- C13H15N3O4
- Molecular weight
- 277.28
Names & synonyms
19572-10-2Ethyl 8-ethyl-5,8-dihydro-2-methoxy-5-oxopyrido(2,3-d)pyrimidine-6-carboxylateEINECS 243-164-0ethyl 8-ethyl-5,8-dihydro-2-methoxy-5-oxopyrido[2,3-d]pyrimidine-6-carboxylateDTXSID10173239RefChem:138856DTXCID2095730243-164-0DB2TUJ3PPDethyl 8-ethyl-2-methoxy-5-oxopyrido[2,3-d]pyrimidine-6-carboxylateethyl 8-ethyl-2-methoxy-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylateSCHEMBL11340226
Show more names
8-Ethyl-5,8-dihydro-2-methoxy-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester
NS000263786-ethoxycarbonyl-8-ethyl-2-methoxy-5-oxo-5,8-dihydro-pyrido[2,3-d]pyrimidinePyrido[2,3-d]pyrimidine-6-carboxylic acid, 8-ethyl-5,8-dihydro-2-methoxy-5-oxo-, ethyl ester
Database identifiers
- CAS
19572-10-2- PubChem CID
- 88152
- DTXSID
DTXSID10173239- UNII
- DB2TUJ3PPD
- EC Number
- 243-164-0
- Nikkaji
- J225.227I
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 81.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 424
Physicochemical properties
- Boiling point
- 425.8 · 425.8±55.0 °C(Predicted)
- Density
- 1.276 · 1.276±0.06 g/cm3(Predicted)
- pka
- 1.98 · 1.98±0.20(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
2 records
Compound notes
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