Compound C25H15ClN7Na3O10S3

trisodium;5-[(4-anilino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate

CAS: 23211-47-4

Molecular Formula	`C25H15ClN7Na3O10S3`
Molecular Weight	774.0 g/mol
Topological Polar Surface Area	304.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	17
Rotatable Bonds	6
Exact Mass	772.94244
Heavy Atoms	49
Complexity	1360.0

Chemical Identifiers

CAS Number	23211-47-4
SMILES	`C1=CC=C(C=C1)NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=C4O)N=NC5=CC=CC=C5S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]`
InChIKey	`WDWBPYFNRWQKNZ-UHFFFAOYSA-K`

📖 Product Overview

Compound C25H15ClN7Na3O10S3 (CAS: 23211-47-4) is a chemical compound with molecular formula C25H15ClN7Na3O10S3 and molecular weight 774.0 g/mol. Its IUPAC systematic name is trisodium;5-[(4-anilino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate. Topological Polar Surface Area 304.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 17 Rotatable Bonds 6 Exact Mass 772.94244 Heavy Atoms 49 Complexity 1360.0 InChI Key: WDWBPYFNRWQKNZ-UHFFFAOYSA-K. SMILES: C1=CC=C(C=C1)NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=C4O)N=NC5=CC=CC=C5S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].

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