3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-ethyl-9-oxo-2,4,6,8-tetrakis(p-chlorophenyl)-

HCID 54829

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Basic information

CAS: 82058-43-3
Standard SMILES: CCNC(=O)N1C(c2ccc(Cl)cc2)C2C(=O)C(C(c3ccc(Cl)cc3)NC2c2ccc(Cl)cc2)C1c1ccc(Cl)cc1
InChIKey: KSSKVLAGUBUECK-UHFFFAOYSA-N
Molecular formula: C34H29Cl4N3O2
Average molar mass: 653.4 g/mol
Monoisotopic mass: 651.101388

Names & identifiers

Preferred name: 3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-ethyl-9-oxo-2,4,6,8-tetrakis(p-chlorophenyl)-
IUPAC: 2,4,6,8-tetrakis(4-chlorophenyl)-N-ethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
English name: 3,7-DIAZABICYCLO(3.3.1)NONANE-3-CARBOXAMIDE, N-ETHYL-9-OXO-2,4,6,8-TET RAKIS(p-CH
Molecular formula: C34H29Cl4N3O2
Molecular weight: 653.42496

Names & synonyms

ITA 47682058-43-3BRN 5694991N-Ethyl-9-oxo-2,4,6,8-tetrakis(p-chlorophenyl)-3,7-diazabicyclo(3.3.1)nonane-3-carboxamide3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-ethyl-9-oxo-2,4,6,8-tetrakis(p-chlorophenyl)-RefChem:272546DTXSID9010024502,4,6,8-Tetrakis(4-chlorophenyl)-N-ethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3-carboximidic acid3,7-DIAZABICYCLO(3.3.1)NONANE-3-CARBOXAMIDE, N-ETHYL-9-OXO-2,4,6,8-TET RAKIS(p-CH

Database identifiers

CAS: 82058-43-3
PubChem CID: 54829
DTXSID: DTXSID901002450
Nikkaji: J68.380I

Properties

Computed structural properties

XLogP: 7.4
Topological polar surface area: 61.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 43
Formal charge: 0
Complexity: 891

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

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