Compound C40H27N7O13S4

3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-6-sulfonaphthalen-1-yl]diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1,5-disulfonic acid

CAS: 25255-02-1

Molecular Formula	`C40H27N7O13S4`
Molecular Weight	941.9 g/mol
LogP	6.2
Topological Polar Surface Area	371.0 A2
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	20
Rotatable Bonds	10
Exact Mass	941.055
Heavy Atoms	64
Complexity	2210.0

Chemical Identifiers

CAS Number	25255-02-1
SMILES	`C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC4=C(C=CC=C4S(=O)(=O)O)C(=C3)S(=O)(=O)O)N=NC5=C6C=CC(=CC6=C(C=C5)N=NC7=C(C=C8C=C(C=CC8=C7O)N)S(=O)(=O)O)S(=O)(=O)O`
InChIKey	`UVPBSQSZCVRVOH-UHFFFAOYSA-N`

📖 Product Overview

Compound C40H27N7O13S4 (CAS: 25255-02-1) is a chemical compound with molecular formula C40H27N7O13S4 and molecular weight 941.9 g/mol. Its IUPAC systematic name is 3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-6-sulfonaphthalen-1-yl]diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1,5-disulfonic acid. LogP 6.2 Topological Polar Surface Area 371.0 A2 Hydrogen Bond Donors 6 Hydrogen Bond Acceptors 20 Rotatable Bonds 10 Exact Mass 941.055 Heavy Atoms 64 Complexity 2210.0 InChI Key: UVPBSQSZCVRVOH-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC4=C(C=CC=C4S(=O)(=O)O)C(=C3)S(=O)(=O)O)N=NC5=C6C=CC(=CC6=C(C=C5)N=NC7=C(C=C8C=C(C=CC8=C7O)N)S(=O)(=O)O)S(=O)(=O)O.

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