HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylate

HCID 178698982
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
146763-34-0
Standard SMILES
CCOC(=O)C1=C(C)N(c2ccc(OC)cc2)C(C)=C(C(=O)OCC)C1c1ccc(C)cc1
InChIKey
KLYVFNWHAJMADR-UHFFFAOYSA-N
Molecular formula
C27H31NO5
Average molar mass
449.5 g/mol
Monoisotopic mass
449.22022309

Names & identifiers

Preferred name
diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylate
IUPAC
diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylate
English name
diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydro-3,5-pyridinedicarboxylate
Molecular formula
C27H31NO5
Molecular weight
449.53874

Names & synonyms

diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydro-3,5-pyridinedicarboxylateOprea1_112063AK-968/36977283diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylate

Database identifiers

CAS
146763-34-0
PubChem CID
1021442
Nikkaji
J518.176C

Properties

Computed structural propertiesFilling in

XLogP
5.3
Topological polar surface area
65.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
33
Formal charge
0
Complexity
727

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes