3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-, 3-methyl ester

Base Information

• Chemical Name: 3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-, 3-methyl ester
• CAS No.: 103232-74-2
• Deprecated CAS: 104871-32-1
• Molecular Formula: C16H15N3O5
• Molecular Weight: 329.30700
• UNII: 70G0R3KF0G
• Wikidata: Q27265859
• Mol file: 103232-74-2.mol

Synonyms:PN-204-144;103232-74-2;UNII-70G0R3KF0G;70G0R3KF0G;3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-, 3-methyl ester;4-(2,1,3-benzoxadiazol-4-yl)-5-methoxycarbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid;SCHEMBL4801745;CHEBI:190082;Q27265859

Chemical Property of 3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-, 3-methyl ester

Chemical Property:

• PSA: 114.55000
• LogP: 2.04400
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 329.10117059
• Heavy Atom Count: 24
• Complexity: 627

Purity/Quality:

95%+ or 98%+ ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC3=NON=C32)C(=O)O

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