Basic information
- Standard SMILES
CCOC(=O)C1=C(C)NC(=O)NC1c1ccc(OC)c(OC)c1- InChIKey
OBEBHPPWYNUWBE-UHFFFAOYSA-N- Molecular formula
- C16H20N2O5
- Average molar mass
- 320.34 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
- IUPAC
- ethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Names & synonyms
ethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate56875-96-8ethyl 4-(3,4-dimethoxyphenyl)-2-hydroxy-6-methyl-1,4-dihydro-5-pyrimidinecarboxylateOBEBHPPWYNUWBE-UHFFFAOYSA-NMaybridge1_004301ethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylateOprea1_355741Oprea1_537149CHEMBL2385745SCHEMBL10112909SCHEMBL28142608HMS553L13
Show more names
STK363898STK636316AKOS000520545AKOS005567839AKOS016378645EBC-611789AE-848/08810005AG-690/12407174
Database identifiers
- PubChem CID
- 625994
- ChEMBL
CHEMBL2385745- Nikkaji
- J1.186.851G
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 85.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 491
Related reactions
1 records
Compound notes
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