Home Aminos 3-((4-(pyrrolidin-1-yl)pyrimidin-2-yl)amino)benzoic acid

3-((4-(pyrrolidin-1-yl)pyrimidin-2-yl)amino)benzoic acid

CAS No.:
1239757-39-1
Catalog Number:
AG01BJAA
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BJAA
Chemical Name:
3-((4-(pyrrolidin-1-yl)pyrimidin-2-yl)amino)benzoic acid
CAS Number:
1239757-39-1
MDL Number:
MFCD16629495
IUPAC Name:
3-[(4-pyrrolidin-1-ylpyrimidin-2-yl)amino]benzoic acid
InChI:
InChI=1S/C15H16N4O2/c20-14(21)11-4-3-5-12(10-11)17-15-16-7-6-13(18-15)19-8-1-2-9-19/h3-7,10H,1-2,8-9H2,(H,20,21)(H,16,17,18)
InChI Key:
GNUPAKSQMMDDPZ-UHFFFAOYSA-N
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.127g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.319g/mol
Monoisotopic Mass:
284.127g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties