7-Quinazolinecarboxamide, 3,4-dihydro-N-butyl-2-methyl-3-(2-methylphenyl)-4-oxo-, hydrochloride, hydrate (2:2:1)

Base Information

• Chemical Name: 7-Quinazolinecarboxamide, 3,4-dihydro-N-butyl-2-methyl-3-(2-methylphenyl)-4-oxo-, hydrochloride, hydrate (2:2:1)
• CAS No.: 74101-62-5
• Molecular Formula: C21H23 N3 O2 . Cl H
• Molecular Weight: 789.8
• DSSTox Substance ID: DTXSID10225045
• Mol file: 74101-62-5.mol

Synonyms:7-Quinazolinecarboxamide, 3,4-dihydro-N-butyl-2-methyl-3-(2-methylphenyl)-4-oxo-, hydrochloride, hydrate (2:2:1);74101-62-5;2-Methyl-3-o-tolyl-7-(N-butylcarboxamide)-4(3H)-quinazolone hydrochloride hemihydrate;DTXSID10225045;C21H23N3O2.ClH.1/2H2O;LS-140024;C21-H23-N3-O2.Cl-H.1/2H2-O

Chemical Property of 7-Quinazolinecarboxamide, 3,4-dihydro-N-butyl-2-methyl-3-(2-methylphenyl)-4-oxo-, hydrochloride, hydrate (2:2:1)

Chemical Property:

• PSA: 67.48000
• LogP: 4.90920
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 385.1557047
• Heavy Atom Count: 27
• Complexity: 560

Purity/Quality:

3,4-DIHYDRO-N-BUTYL-2-METHYL-3-(2-METHYLPHENYL)-4-OXO-7-QUINAZOLINECARBOXAMIDE HYDROCHLORIDE HYDRATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)C)C3=CC=CC=C3C.Cl

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