Basic information
- Standard SMILES
CCOC(=O)C1=C(N)NC(c2ccccc2)=C(C(=O)O)C1c1ccccc1- InChIKey
NOBGYQDHDDGLEO-UHFFFAOYSA-N- Molecular formula
- C21H20N2O4
- Average molar mass
- 364.4 g/mol
Names & identifiers
- Preferred name
- 2-Amino-4,6-diphenyl-1,4-dihydropyridine-3,5-dicarboxylic acid ethyl ester
- IUPAC
- 6-amino-5-ethoxycarbonyl-2,4-diphenyl-1,4-dihydropyridine-3-carboxylic acid
Names & synonyms
SCHEMBL11691621NOBGYQDHDDGLEO-UHFFFAOYSA-N2-amino-4,6-diphenyl-1,4-dihydropyridine-3,5-dicarboxylic acid ethyl ester2-amino-4,6 -diphenyl-1,4-dihydropyridine-3,5-dicarboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 70635527
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 641
Related reactions
8 records
Compound notes
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