AC1MHMXS

4-[[2-[3-[2-(4-carboxyanilino)-2-oxoethyl]-5,5-diethyl-2,4,6-trioxo-1,3-diazinan-1-yl]acetyl]amino]benzoic acid

Also Known As: 1,3(2H,4H)-Pyrimidine-2,4,6-trione, 5,5-diethyldihydro-1,3-bis(carboxyphenylcarbamoylmethyl)-|Benzoic acid, 4,4'-((5,5-diethyldihydro-2,4,6-trioxo-1,3(2H,4H)-pyrimidinediyl)bis(1-oxo-2,1-ethanediyl)imino))bis-|4,4'-{(5,5-Diethyl-2,4,6-trioxo-1,3-diazinane-1,3-diyl)bis[(1-oxoethane-2,1-diyl)azanediyl]}dibenzoic acid|4-[[2-[3-[2-(4-carboxyanilino)-2-oxoethyl]-5,5-diethyl-2,4,6-trioxo-1,3-diazinan-1-yl]acetyl]amino]benzoic acid

Molecular Formula	C26H26N4O9
Molecular Weight	538.17 g/mol
LogP	2.2574
Topological Polar Surface Area	190.49 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	7
Rotatable Bonds	10
Exact Mass	538.17
Monoisotopic Mass	538.17
Heavy Atoms	39
Complexity	1234.7019

Chemical Identifiers

CAS Number	70959-45-4
SMILES	CCC1(C(=O)N(C(=O)N(C1=O)CC(=O)NC2=CC=C(C=C2)C(=O)O)CC(=O)NC3=CC=C(C=C3)C(=O)O)CC