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

Base Information

• Chemical Name: Butanoic acid, 4-((7-(4-chlorophenyl)-4,7-dihydro-5-methyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-yl)amino)-4-oxo-
• CAS No.: 171668-00-1
• Molecular Formula: C16H16 Cl N5 O3
• Molecular Weight: 361.7829
• DSSTox Substance ID: DTXSID40938015
• ChEMBL ID: CHEMBL1351725
• Mol file: 171668-00-1.mol

Synonyms:171668-00-1;N-(5-Methyl-7-(4-chlorophenyl)-4,7-dihydro-as-triazolo(1,5-a)pyrimidin-2-yl)succinaminic acid;Butanoic acid, 4-((7-(4-chlorophenyl)-4,7-dihydro-5-methyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-yl)amino)-4-oxo-;C16H16ClN5O3;MLS000122866;CHEMBL1351725;DTXSID40938015;HMS2755E07;C16-H16-Cl-N5-O3;STK540617;AKOS000641617;NCGC00245527-01;LS-46163;SMR000123475;4-{[7-(4-Chlorophenyl)-5-methyl-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]imino}-4-hydroxybutanoic acid;4-{[7-(4-chlorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-4-oxobutanoic acid;N-[7-(4-Chloro-phenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-succinamic acid

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

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.54g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 361.0941671
• Heavy Atom Count: 25
• Complexity: 550

Purity/Quality:

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=C(C=C3)Cl