AC1MIGXV

4-(3-carboxy-2-hydroxynaphthalen-1-yl)-3-hydroxynaphthalene-2-carboxylic acid;N-methyl-2-(11-methylbenzo[b][1]benzazepin-5-yl)ethanamine

Also Known As: RU 21600|5H-Dibenz(b,f)azepine-10-ethanamine, N,5-dimethyl-, 2,2'-dihydroxy(1,1'-binaphthalene)-3,3'-dicarboxylate (1:1)|2,2'-Dihydroxy[1,1'-binaphthalene]-3,3'-dicarboxylic acid--N-methyl-2-(5-methyl-5H-dibenzo[b,f]azepin-10-yl)ethan-1-amine (1/1)|4-(3-carboxy-2-hydroxynaphthalen-1-yl)-3-hydroxynaphthalene-2-carboxylic acid; N-methyl-2-(11-methylbenzo[b][1]benzazepin-5-yl)ethanamine

Molecular Formula	C40H34N2O6
Molecular Weight	638.2417 g/mol
LogP	8.3856
Topological Polar Surface Area	130.33 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	638.2417
Monoisotopic Mass	638.2417
Heavy Atoms	48
Complexity	2138.7605

Chemical Identifiers

CAS Number	84142-16-5
SMILES	CNCCC1=CC2=CC=CC=C2N(C3=CC=CC=C31)C.C1=CC=C2C(=C1)C=C(C(=C2C3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O