5,7,12,14-Tetrahydro-7,14-dioxoquino[2,3-b]acridine-2,9-disulfonyl dichloride

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Basic information

CAS: 483965-67-9
Standard SMILES: O=c1c2cc(S(=O)(=O)Cl)ccc2[nH]c2cc3c(=O)c4cc(S(=O)(=O)Cl)ccc4[nH]c3cc12
InChIKey: DAMDOSAXJSLBLI-UHFFFAOYSA-N
Molecular formula: C20H10Cl2N2O6S2
Average molar mass: 509.3 g/mol
Monoisotopic mass: 507.9357338

Overview

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Names & identifiers

Preferred name: 5,7,12,14-Tetrahydro-7,14-dioxoquino[2,3-b]acridine-2,9-disulfonyl dichloride
IUPAC: 7,14-dioxo-5,12-dihydroquinolino[2,3-b]acridine-2,9-disulfonyl chloride

Names & synonyms

5,7,12,14-Tetrahydro-7,14-dioxoquino[2,3-b]acridine-2,9-disulfonyl dichloride5,7,12,14-Tetrahydro-7,14-dioxoquino(2,3-b)acridine-2,9-disulfonyl dichlorideRefChem:528144DTXSID501140086NS000053967,14-Dioxo-5,7,12,14-tetrahydroquinolino[2,3-b]acridine-2,9-disulfonyl dichloride483965-67-9

Database identifiers

CAS: 483965-67-9
PubChem CID: 92030575
DTXSID: DTXSID501140086

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 143 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 8
Rotatable bonds: 2
Heavy atoms: 32
Formal charge: 0
Complexity: 942

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Compound notes

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