Basic information
- CAS
330472-47-4- Standard SMILES
COCCOC(=O)C1=C(C)NC(=O)NC1c1ccc(Cl)cc1- InChIKey
OKPFPPIFEZEMLY-UHFFFAOYSA-N- Molecular formula
- C15H17ClN2O4
- Average molar mass
- 324.76 g/mol
Names & identifiers
- Preferred name
- 2-Methoxyethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
- IUPAC
- 2-methoxyethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
- English name
- 2-methoxyethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
- Molecular formula
- C15H17ClN2O4
- Molecular weight
- 324.76
Names & synonyms
2-methoxyethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate5616-27-3DTXSID20386237RefChem:262773DTXCID70337259330472-47-4MLS000107458CHEMBL1599244HMS2499O19CCG-20373STK402584AKOS000655142
Show more names
2-METHOXYETHYL 4-(4-CHLOROPHENYL)-6-ME-2-OXO-1,2,3,4-4H-5-PYRIMIDINECARBOXYLATE5-Pyrimidinecarboxylic acid, 4-(4-chlorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 2-methoxyethyl ester
AKOS0162912342-methoxyethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylateSMR000111826EU-0044819AB00090610-01SR-01000492714SR-01000492714-1Z47754162
Database identifiers
- CAS
330472-47-4- ChEMBL
CHEMBL1599244
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 458
Physicochemical properties
- Boiling point
- 445.2 · 445.2±45.0 °C(Predicted)
- Density
- 1.261 · 1.261±0.06 g/cm3(Predicted)
- pka
- 11.04 · 11.04±0.70(Predicted)
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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