BRN 0729553

4-[[3,4-dimethoxy-2-(pyrrolidine-1-carbonyl)phenyl]methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one

CAS: 66913-52-8

Molecular Formula	`C25H28N4O4`
Molecular Weight	448.5 g/mol
LogP	3.4
Topological Polar Surface Area	74.7 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	448.21106
Heavy Atoms	33
Complexity	785.0

Chemical Identifiers

CAS Number	66913-52-8
SMILES	`CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C(=C(C=C3)OC)OC)C(=O)N4CCCC4`
InChIKey	`WAMDKQYNVFXCES-UHFFFAOYSA-N`

📖 Product Overview

BRN 0729553 (CAS: 66913-52-8) is a chemical compound with molecular formula C25H28N4O4 and molecular weight 448.5 g/mol. Its IUPAC systematic name is 4-[[3,4-dimethoxy-2-(pyrrolidine-1-carbonyl)phenyl]methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one. LogP 3.4 Topological Polar Surface Area 74.7 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 448.21106 Heavy Atoms 33 Complexity 785.0 InChI Key: WAMDKQYNVFXCES-UHFFFAOYSA-N. SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C(=C(C=C3)OC)OC)C(=O)N4CCCC4.

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

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