Pentanedioic acid, 3-((4-(((2,4-diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)amino)-

Base Information

• Chemical Name: Pentanedioic acid, 3-((4-(((2,4-diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)amino)-
• CAS No.: 69827-75-4
• Molecular Formula: C22H24N6O5
• Molecular Weight: 452.4632
• NSC Number: 129516
• UNII: F3T5N663O6
• DSSTox Substance ID: DTXSID50220115
• Nikkaji Number: J423.352B
• Wikidata: Q83097208
• ChEMBL ID: CHEMBL3228303

Synonyms:69827-75-4;Pentanedioic acid, 3-((4-(((2,4-diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)amino)-;F3T5N663O6;NSC129516;NSC-129516;3-(4-(((2,4-Diamino-5-methylquinazolin-6-yl)methyl)amino)benzamido)pentanedioic acid;Pentanedioic acid, 3-((4-(((2,4-diamino-5-methyl-6-quinazolinyl)methyl-;3-((4-(((2,4-Diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)amino)pentanedioic acid;Pentanedioic acid der.;Pentanedioic acid, 3-[[4-[[(2,4-diamino-5-methyl-6-quinazolinyl)methyl-;Pentanedioic acid, 3-[[4-[[(2,4-diamino-5-methyl-6-quinazolinyl)methyl]amino]benzoyl]amino]-;NSC 129516;UNII-F3T5N663O6;CHEMBL3228303;DTXSID50220115;3-[[4-[(2,4-diamino-5-methyl-quinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid;Pentanedioic acid,4-diamino-5-methyl-6-quinazolinyl)methyl]amino]benzoyl]amino]-;3-[(4-{[(2,4-diamino-5-methylquinazolin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid

Chemical Property of Pentanedioic acid, 3-((4-(((2,4-diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)amino)-

Chemical Property:

• Density: 1.473g/cm³
• XLogP3: 1
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 9
• Exact Mass: 452.18081789
• Heavy Atom Count: 33
• Complexity: 685

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC2=C1C(=NC(=N2)N)N)CNC3=CC=C(C=C3)C(=O)NC(CC(=O)O)CC(=O)O

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