5-Butan-2-yloxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid

Base Information

• Chemical Name: 5-Butan-2-yloxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid
• CAS No.: 74936-74-6
• Molecular Formula: C19H22N2O6
• Molecular Weight: 374.4
• DSSTox Substance ID: DTXSID601125087

Synonyms:74936-74-6;DTXSID601125087;3-(1-Methylpropyl) 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate

Chemical Property of 5-Butan-2-yloxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 374.14778643
• Heavy Atom Count: 27
• Complexity: 691

Purity/Quality:

> 95% ^*data from raw suppliers

LercanidipineImpurityA ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCC(C)OC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C)C
• Uses: Lercanidipine Impurity A, is an impurity of Lercanidipine (L179000), a dihydropyridine calcium channel blocker. Antihypertensive.

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