ITA 431

N-cyclohexyl-9-oxo-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide

CAS: 82058-28-4

Molecular Formula	`C38H39N3O2`
Molecular Weight	569.7 g/mol
LogP	6.3
Topological Polar Surface Area	61.4 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	569.3042
Heavy Atoms	43
Complexity	867.0

Chemical Identifiers

CAS Number	82058-28-4
SMILES	`C1CCC(CC1)NC(=O)N2C(C3C(NC(C(C2C4=CC=CC=C4)C3=O)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7`
InChIKey	`XJEDJDYJFNUOLS-UHFFFAOYSA-N`

📖 Product Overview

ITA 431 (CAS: 82058-28-4) is a chemical compound with molecular formula C38H39N3O2 and molecular weight 569.7 g/mol. Its IUPAC systematic name is N-cyclohexyl-9-oxo-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide. LogP 6.3 Topological Polar Surface Area 61.4 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 569.3042 Heavy Atoms 43 Complexity 867.0 InChI Key: XJEDJDYJFNUOLS-UHFFFAOYSA-N. SMILES: C1CCC(CC1)NC(=O)N2C(C3C(NC(C(C2C4=CC=CC=C4)C3=O)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Frequently Asked Questions

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Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.

What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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