Home Aminos 4-[(4-phenylquinazolin-2-yl)amino]benzoic acid

4-[(4-phenylquinazolin-2-yl)amino]benzoic acid

CAS No.:
332102-09-7
Catalog Number:
AG01DFJY
Molecular Formula:
C21H15N3O2
Molecular Weight:
341.3627
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Product Description
Catalog Number:
AG01DFJY
Chemical Name:
4-[(4-phenylquinazolin-2-yl)amino]benzoic acid
CAS Number:
332102-09-7
Molecular Formula:
C21H15N3O2
Molecular Weight:
341.3627
IUPAC Name:
4-[(4-phenylquinazolin-2-yl)amino]benzoic acid
InChI:
InChI=1S/C21H15N3O2/c25-20(26)15-10-12-16(13-11-15)22-21-23-18-9-5-4-8-17(18)19(24-21)14-6-2-1-3-7-14/h1-13H,(H,25,26)(H,22,23,24)
InChI Key:
WWZYTCHSHCEEGJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)Nc1nc2ccccc2c(n1)c1ccccc1
Properties
Complexity:
472  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.116g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
341.37g/mol
Monoisotopic Mass:
341.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties