Basic information
- CAS
54504-53-9- Standard SMILES
CCOC(=O)Cc1cnc2n(c1=O)CCCC2- InChIKey
GPICITVVVLYZNF-UHFFFAOYSA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.11609238
Names & identifiers
- Preferred name
- 4H-Pyrido[1,2-a]pyrimidine-3-acetic acid, 6,7,8,9-tetrahydro-4-oxo-, ethyl ester
- IUPAC
- ethyl 2-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetate
- English name
- 6,7,8,9-Tetrahydro-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-acetic acid ethyl ester
- Molecular formula
- C12H16N2O3
- Molecular weight
- 236.27
Names & synonyms
54504-53-93-Carbethoxymethyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one4H-Pyrido[1,2-a]pyrimidine-3-acetic acid, 6,7,8,9-tetrahydro-4-oxo-, ethyl esterGPICITVVVLYZNF-UHFFFAOYSA-NDTXSID5013469636,7,8,9-Tetrahydro-4-oxo-4h-pyrido[1,2-a]pyrimidine-3-acetic acid ethyl esterDB-317903Q633935253-Carboethoxymethyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one4-OXO-6,7,8,9-TETRAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-ACETIC ACID ETHYL ESTEREthyl (4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-3-yl)acetate #4-Oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidine-3-acetic acid ethyl ester
Show more names
(4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-3-yl)-acetic acid ethyl ester
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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