AC1L8QX7

ethoxy-[[4-[[ethoxy(hydroxy)phosphoryl]-(4-phenyldiazenylanilino)methyl]phenyl]-(4-phenyldiazenylanilino)methyl]phosphinic acid

Also Known As: NCI60_027710|ethoxy-[[4-[[ethoxy(hydroxy)phosphoryl]-[4-[(E)-phenylazo]anilino]methyl]phenyl]-[4-[(E)-phenylazo]anilino]methyl]phosphinic acid|Diethyl (1,4-phenylenebis{[4-(phenyldiazenyl)anilino]methylene})bis[hydrogen (phosphonate)]|ethoxy-[[4-[[ethoxy(hydroxy)phosphoryl]-(4-phenyldiazenylanilino)methyl]phenyl]-(4-phenyldiazenylanilino)methyl]phosphinic acid|Ethyl hydrogen {4-[[ethoxy(hydroxy)phosphoryl]({4-[(E)-phenyldiazenyl]phenyl}amino)methyl]phenyl}({4-[(E)-phenyldiazenyl]phenyl}amino)methylphosphonate|Phosphonic acid, [1,4-phenylenebis[[[4-(phenylazo)phenyl]amino]methylene]]bis-, P,Pa(2)-diethyl ester

Molecular Formula	C36H38N6O6P2
Molecular Weight	712.2328 g/mol
LogP	6.8
Topological Polar Surface Area	167.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	12
Rotatable Bonds	16
Exact Mass	712.2328
Monoisotopic Mass	712.2328
Heavy Atoms	50
Complexity	1060.0

Chemical Identifiers

CAS Number	754159-39-2
SMILES	CCOP(=O)(C(C1=CC=C(C=C1)C(NC2=CC=C(C=C2)N=NC3=CC=CC=C3)P(=O)(O)OCC)NC4=CC=C(C=C4)N=NC5=CC=CC=C5)O
InChIKey	JNPLCGCDHLGTLQ-UHFFFAOYSA-N