CHEMBL1091751

7-[[6-[(2-amino-6-sulfonaphthalen-1-yl)diazenyl]-5-hydroxy-7-sulfonaphthalen-2-yl]carbamoylamino]-4-hydroxy-3-[(2-methoxyphenyl)diazenyl]naphthalene-2-sulfonic acid

Also Known As: Naphthalenedisulfonic acid der.|2-Naphthalenesulfonic acid, trisodium salt|3-((2-amino-6-sulfonaphthalen-1-yl)diazenyl)-4-hydroxy-7-(3-(5-hydroxy-6-((2-methoxyphenyl)diazenyl)-7-sulfonaphthalen-2-yl)ureido)naphthalene-2-sulfonic acid|2-Naphthalenesulfonic acid, 3-[(E)-(2-amino-6-sulfo-1-naphthalenyl)azo]-4-hydroxy-7-[[[[5-hydroxy-6-[(E)-(2-methoxyphenyl)azo]-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-|7-[[6-[(E)-(2-amino-6-sulfo-1-naphthyl)azo]-5-hydroxy-7-sulfo-2-naphthyl]carbamoylamino]-4-hydroxy-3-[(E)-(2-methoxyphenyl)azo]naphthalene-2-sulfonic acid

Molecular Formula	C38H29N7O13S3
Molecular Weight	887.0986 g/mol
LogP	4.6
Topological Polar Surface Area	355.0 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	18
Rotatable Bonds	10
Exact Mass	887.0986
Monoisotopic Mass	887.0986
Heavy Atoms	61
Complexity	1950.0

Chemical Identifiers

CAS Number	7147-79-7
SMILES	COC1=CC=CC=C1N=NC2=C(C=C3C=C(C=CC3=C2O)NC(=O)NC4=CC5=CC(=C(C(=C5C=C4)O)N=NC6=C(C=CC7=C6C=CC(=C7)S(=O)(=O)O)N)S(=O)(=O)O)S(=O)(=O)O
InChIKey	FUQRIISLSITXHV-UHFFFAOYSA-N