BRN 5159521

N-[1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-3-methyl-1-oxobutan-2-yl]benzamide

CAS: 81216-99-1

Molecular Formula	`C23H26N4O3`
Molecular Weight	406.5 g/mol
LogP	3.7
Topological Polar Surface Area	81.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	406.2005
Heavy Atoms	30
Complexity	691.0

Chemical Identifiers

CAS Number	81216-99-1
SMILES	`CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C(C)C)NC(=O)C3=CC=CC=C3`
InChIKey	`WVJXWKFQYKXWRN-UHFFFAOYSA-N`

📖 Product Overview

BRN 5159521 (CAS: 81216-99-1) is a chemical compound with molecular formula C23H26N4O3 and molecular weight 406.5 g/mol. Its IUPAC systematic name is N-[1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-3-methyl-1-oxobutan-2-yl]benzamide. LogP 3.7 Topological Polar Surface Area 81.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 406.2005 Heavy Atoms 30 Complexity 691.0 InChI Key: WVJXWKFQYKXWRN-UHFFFAOYSA-N. SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C(C)C)NC(=O)C3=CC=CC=C3.

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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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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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