1-[(4-amino-3-methylphenyl)methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid

Base Information

• Chemical Name: 1-[(4-amino-3-methylphenyl)methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid
• CAS No.: 114785-12-5
• Molecular Formula: C29H28 N4 O3
• Molecular Weight: 480.5576
• DSSTox Substance ID: DTXSID90921497
• Nikkaji Number: J386.726I
• Wikidata: Q27088257
• ChEMBL ID: CHEMBL1188080
• Mol file: 114785-12-5.mol

Synonyms:1-((4-amino-3-methylphenyl)methyl)-5-(diphenylacetyl)-4,5,6,7-tetrahydro-1H-imidazo(4,5c)pyridine-6-carboxylic acid;EXP 655;EXP-655;PD 123177;PD-123177

Chemical Property of 1-[(4-amino-3-methylphenyl)methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid

Chemical Property:

• Vapor Pressure: 1.32E-26mmHg at 25°C
• Boiling Point: 794.3°Cat760mmHg
• Flash Point: 434.2°C
• Density: 1.29g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 480.21614077
• Heavy Atom Count: 36
• Complexity: 748

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)CN2C=NC3=C2CC(N(C3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O)N