N-(4-((2-Azido-9-acridinyl)amino)phenyl)methanesulfonamide

HCID 3035366

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Basic information

CAS: 110021-94-8
Standard SMILES: CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3ccc(N=[N+]=[N-])cc23)cc1
InChIKey: SKXCLBMELDCBLB-UHFFFAOYSA-N
Molecular formula: C20H16N6O2S
Average molar mass: 404.4 g/mol
Monoisotopic mass: 404.10554495

Names & identifiers

Preferred name: N-(4-((2-Azido-9-acridinyl)amino)phenyl)methanesulfonamide
IUPAC: N-[4-[(2-azidoacridin-9-yl)amino]phenyl]methanesulfonamide

Names & synonyms

N-(4-((2-Azido-9-acridinyl)amino)phenyl)methanesulfonamide110021-94-8Methanesulfonamide, N-(4-((2-azido-9-acridinyl)amino)phenyl)-L4IZF83758CCRIS 6374UNII-L4IZF83758N-[4-[(2-AZIDO-9-ACRIDINYL)AMINO]PHENYL]METHANESULFONAMIDECHEMBL105862DTXSID00911440Q27282695N-{4-[(2-Azidoacridin-9(10H)-ylidene)amino]phenyl}methanesulfonamide

Database identifiers

CAS: 110021-94-8
PubChem CID: 3035366
DTXSID: DTXSID00911440
ChEMBL: CHEMBL105862
UNII: L4IZF83758

Properties

Computed structural properties

XLogP: 5
Topological polar surface area: 93.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 7
Rotatable bonds: 5
Heavy atoms: 29
Formal charge: 0
Complexity: 711

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