CHEMBL1269664

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

CAS: 25255-05-4

Molecular Formula	`C34H27N5O10S2`
Molecular Weight	729.7 g/mol
LogP	5.6
Topological Polar Surface Area	260.0 A2
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	15
Rotatable Bonds	9
Exact Mass	729.11993
Heavy Atoms	51
Complexity	1460.0

Chemical Identifiers

CAS Number	25255-05-4
SMILES	`COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C4C=C(C=CC4=C3O)N)S(=O)(=O)O)OC)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)O)O`
InChIKey	`DAUWYVUKZMSMCP-UHFFFAOYSA-N`

📖 Product Overview

CHEMBL1269664 (CAS: 25255-05-4) is a chemical compound with molecular formula C34H27N5O10S2 and molecular weight 729.7 g/mol. Its IUPAC systematic name is 7-amino-4-hydroxy-3-[[4-[4-[(1-hydroxy-4-sulfonaphthalen-2-yl)diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]naphthalene-2-sulfonic acid. LogP 5.6 Topological Polar Surface Area 260.0 A2 Hydrogen Bond Donors 5 Hydrogen Bond Acceptors 15 Rotatable Bonds 9 Exact Mass 729.11993 Heavy Atoms 51 Complexity 1460.0 InChI Key: DAUWYVUKZMSMCP-UHFFFAOYSA-N. SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C4C=C(C=CC4=C3O)N)S(=O)(=O)O)OC)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)O)O.

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