Compound C27H31ClN4O4S

(1-carbamoylacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride

CAS: 71803-05-9

Molecular Formula	`C27H31ClN4O4S`
Molecular Weight	543.1 g/mol
Topological Polar Surface Area	136.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	7
Rotatable Bonds	11
Exact Mass	542.1755
Heavy Atoms	37
Complexity	819.0

Chemical Identifiers

CAS Number	71803-05-9
SMILES	`CCCCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C(=NC4=CC=CC=C42)C=CC=C3C(=O)N)OC.[Cl-]`
InChIKey	`LQBNHXYOJAUJPS-UHFFFAOYSA-N`

📖 Product Overview

Compound C27H31ClN4O4S (CAS: 71803-05-9) is a chemical compound with molecular formula C27H31ClN4O4S and molecular weight 543.1 g/mol. Its IUPAC systematic name is (1-carbamoylacridin-9-yl)-[4-(hexylsulfonylamino)-2-methoxyphenyl]azanium chloride. Topological Polar Surface Area 136.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 7 Rotatable Bonds 11 Exact Mass 542.1755 Heavy Atoms 37 Complexity 819.0 InChI Key: LQBNHXYOJAUJPS-UHFFFAOYSA-N. SMILES: CCCCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C(=NC4=CC=CC=C42)C=CC=C3C(=O)N)OC.[Cl-].

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