Butanoic acid, 4-((4,7-dihydro-5-methyl-7-phenyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-yl)amino)-4-oxo-

Base Information

• Chemical Name: Butanoic acid, 4-((4,7-dihydro-5-methyl-7-phenyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-yl)amino)-4-oxo-
• CAS No.: 171667-99-5
• Molecular Formula: C16H17N5O3
• Molecular Weight: 327.3379
• DSSTox Substance ID: DTXSID80938014
• ChEMBL ID: CHEMBL1412683
• Mol file: 171667-99-5.mol

Synonyms:171667-99-5;N-(5-Methyl-7-phenyl-4,7-dihydro-1,2,4-triazolo(1,5-a)pyrimidin-2-yl)succinaminic acid;Butanoic acid, 4-((4,7-dihydro-5-methyl-7-phenyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-yl)amino)-4-oxo-;3-[(4-METHYL-2-PHENYL-1,5,7,9-TETRAZABICYCLO[4.3.0]NONA-3,5,7-TRIEN-8- YL)CARBAMOYL]PROPANOIC ACID;4-((5-Methyl-7-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)amino)-4-oxobutanoic acid;4-[(5-methyl-7-phenyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)amino]-4-oxobutanoic acid;C16H17N5O3;Oprea1_097269;MLS000778110;CHEMBL1412683;DTXSID80938014;DDRZOYPCABIDOL-UHFFFAOYSA-N;HMS2759H18;STL045950;AKOS001659878;AKOS005699616;C16-H17-N5-O3;NCGC00246466-01;LS-46236;SMR000414504;SR-01000082184;SR-01000082184-1;N-(5-Methyl-7-phenyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-succinamic acid;3-[(4-Methyl-2-phenyl-1,5,7,9-tetrazabicyclo[4.3.0]nona-3,5,7-trien-8-yl)carbamoyl]propanoic acid;4-[(5-methyl-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)amino]-4-oxobutanoic acid;4-Hydroxy-4-[(5-methyl-7-phenyl-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)imino]butanoic acid

Chemical Property of Butanoic acid, 4-((4,7-dihydro-5-methyl-7-phenyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-yl)amino)-4-oxo-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 115.86000
• Density: 1.45g/cm³
• LogP: 1.50710
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 327.13313942
• Heavy Atom Count: 24
• Complexity: 518

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(N2C(=NC(=N2)NC(=O)CCC(=O)O)N1)C3=CC=CC=C3