AC1MX54D

4-[4-[6-[4-(3-carboxypropanoylamino)phenyl]-2-phenylpyrimidin-4-yl]anilino]-4-oxobutanoic acid

Also Known As: Oprea1_081690|4,4'-[(2-phenylpyrimidine-4,6-diyl)bis(benzene-4,1-diylimino)]bis(4-oxobutanoic acid)|3-[N-(4-{6-[4-(3-carboxypropanoylamino)phenyl]-2-phenylpyrimidin-4-yl}phenyl)c arbamoyl]propanoic acid|4,4'-(((2-phenylpyrimidine-4,6-diyl)bis(4,1-phenylene))bis(azanediyl))bis(4-oxobutanoic acid)|4-[4-[6-[4-[(4-hydroxy-4-oxobutanoyl)amino]phenyl]-2-phenylpyrimidin-4-yl]anilino]-4-oxobutanoic acid

Molecular Formula	C30H26N4O6
Molecular Weight	538.18524 g/mol
LogP	5.0842
Topological Polar Surface Area	158.58 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	6
Rotatable Bonds	11
Exact Mass	538.18524
Monoisotopic Mass	538.18524
Heavy Atoms	40
Complexity	1426.8463

Chemical Identifiers

CAS Number	413609-33-3
SMILES	C1=CC=C(C=C1)C2=NC(=CC(=N2)C3=CC=C(C=C3)NC(=O)CCC(=O)O)C4=CC=C(C=C4)NC(=O)CCC(=O)O