1,4-Dihydro-2,6-dimethyl-4-(2',3'-dichorophenyl)-5-carboxymethyl-3-pyridinecarboxylic acid

HCID 66809656

Basic information

Standard SMILES
CC1=C(CC(=O)O)C(c2cccc(Cl)c2Cl)C(C(=O)O)=C(C)N1
InChIKey
YJEMESISMBKYAO-UHFFFAOYSA-N
Molecular formula
C16H15Cl2NO4
Average molar mass
356.2 g/mol

Names & identifiers

Preferred name
1,4-Dihydro-2,6-dimethyl-4-(2',3'-dichorophenyl)-5-carboxymethyl-3-pyridinecarboxylic acid
IUPAC
5-(carboxymethyl)-4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid

Names & synonyms

SCHEMBL819493YJEMESISMBKYAO-UHFFFAOYSA-N1,4-dihydro-2,6-dimethyl-4-(2',3'-dichorophenyl)-5-carboxymethyl-3-pyridinecarboxylic acid1 ,4-dihydro-2,6-dimethyl-4-(2',3'-dichorophenyl)-5-carboxymethyl-3-pyridinecarboxylic acid

Database identifiers

PubChem CID
66809656

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
86.6 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
23

Related reactions

5 records

Compound notes

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