Compound C17H21Cl2N5O7S

[3-(7,8-dichloro-2,4-dioxobenzo[g]pteridin-10-yl)-2-hydroxypropyl]-diethylazanium;hydrogen sulfate

CAS: 93405-68-6

Molecular Formula	`C17H21Cl2N5O7S`
Molecular Weight	510.3 g/mol
Topological Polar Surface Area	185.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	509.05386
Heavy Atoms	32
Complexity	743.0

Chemical Identifiers

CAS Number	93405-68-6
SMILES	`CC[NH+](CC)CC(CN1C2=CC(=C(C=C2N=C3C1=NC(=O)NC3=O)Cl)Cl)O.OS(=O)(=O)[O-]`
InChIKey	`ZYQRAKBBYCLATO-UHFFFAOYSA-N`

📖 Product Overview

Compound C17H21Cl2N5O7S (CAS: 93405-68-6) is a chemical compound with molecular formula C17H21Cl2N5O7S and molecular weight 510.3 g/mol. Its IUPAC systematic name is [3-(7,8-dichloro-2,4-dioxobenzo[g]pteridin-10-yl)-2-hydroxypropyl]-diethylazanium;hydrogen sulfate. Topological Polar Surface Area 185.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 8 Rotatable Bonds 6 Exact Mass 509.05386 Heavy Atoms 32 Complexity 743.0 InChI Key: ZYQRAKBBYCLATO-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CC(CN1C2=CC(=C(C=C2N=C3C1=NC(=O)NC3=O)Cl)Cl)O.OS(=O)(=O)[O-].

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