AC1MLW2E

2-[benzyl-[2-[benzyl-(2-carboxycyclohexanecarbonyl)amino]ethyl]carbamoyl]cyclohexane-1-carboxylic acid

Also Known As: F3145-3178|2,2'-((ethane-1,2-diylbis(benzylazanediyl))bis(carbonyl))dicyclohexanecarboxylic acid|2-({Benzyl[2-(benzyl{[(1R,2S)-2-carboxycyclohexyl]carbonyl}amino)ethyl]amino}carbonyl)cyclohexanecarboxylic acid|2-[benzyl-[2-[benzyl-(2-carboxycyclohexanecarbonyl)amino]ethyl]carbamoyl]cyclohexane-1-carboxylic acid

Molecular Formula	C32H40N2O6
Molecular Weight	548.28864 g/mol
LogP	4.826
Topological Polar Surface Area	115.22 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	11
Exact Mass	548.28864
Monoisotopic Mass	548.28864
Heavy Atoms	40
Complexity	1063.0104

Chemical Identifiers

CAS Number	1242775-34-3
SMILES	C1CCC(C(C1)C(=O)N(CCN(CC2=CC=CC=C2)C(=O)C3CCCCC3C(=O)O)CC4=CC=CC=C4)C(=O)O