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

4-[(quinazolin-4-yl)amino]benzoic acid

CAS No.:
33683-30-6
Catalog Number:
AG00I6MS
Molecular Formula:
C15H11N3O2
Molecular Weight:
265.2667
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Product Description
Catalog Number:
AG00I6MS
Chemical Name:
4-[(quinazolin-4-yl)amino]benzoic acid
CAS Number:
33683-30-6
Molecular Formula:
C15H11N3O2
Molecular Weight:
265.2667
MDL Number:
MFCD02322970
IUPAC Name:
4-(quinazolin-4-ylamino)benzoic acid
InChI:
InChI=1S/C15H11N3O2/c19-15(20)10-5-7-11(8-6-10)18-14-12-3-1-2-4-13(12)16-9-17-14/h1-9H,(H,19,20)(H,16,17,18)
InChI Key:
SGTLIIKTRIMNPW-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)Nc1ncnc2c1cccc2
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.085g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
265.272g/mol
Monoisotopic Mass:
265.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties