Butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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Basic information
- CAS
299404-60-7- Standard SMILES
CCCCOC(=O)C1=C(C)NC(=O)NC1c1ccccc1Cl- InChIKey
YRJINXLPPFDDBC-UHFFFAOYSA-N- Molecular formula
- C16H19ClN2O3
- Average molar mass
- 322.78 g/mol
- Monoisotopic mass
- 322.1084202
Names & identifiers
- Preferred name
- Butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
- IUPAC
- butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
- English name
- butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
- Molecular formula
- C16H19ClN2O3
- Molecular weight
- 322.78666
Names & synonyms
butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylateSTK371659AKOS000637601AKOS022065715butyl 4-(2-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylateEU-0001274ST50225722AG-690/09762040SR-01000397759SR-01000397759-1butyl 6-(2-chlorophenyl)-4-methyl-2-oxo-1,3,6-trihydropyrimidine-5-carboxylate299404-60-7
Database identifiers
- CAS
299404-60-7- PubChem CID
- 2848313
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
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Compound notes
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