[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2-bicyclo[2.2.2]octa-2,5-dienyl)methanone

CAS: 107021-36-3

Molecular Formula	`C23H27N5O3`
Molecular Weight	421.5 g/mol
LogP	3.0
Topological Polar Surface Area	93.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	4
Exact Mass	421.2114
Heavy Atoms	31
Complexity	735.0

Chemical Identifiers

CAS Number	107021-36-3
SMILES	`COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC5CCC4C=C5)N)OC`
InChIKey	`MXXRJJCMLRPJOF-UHFFFAOYSA-N`

📖 Product Overview

[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2-bicyclo[2.2.2]octa-2,5-dienyl)methanone (CAS: 107021-36-3) is a chemical compound with molecular formula C23H27N5O3 and molecular weight 421.5 g/mol. Its IUPAC systematic name is [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2-bicyclo[2.2.2]octa-2,5-dienyl)methanone. LogP 3.0 Topological Polar Surface Area 93.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 4 Exact Mass 421.2114 Heavy Atoms 31 Complexity 735.0 InChI Key: MXXRJJCMLRPJOF-UHFFFAOYSA-N. SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC5CCC4C=C5)N)OC.

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2-bicyclo[2.2.2]octa-2,5-dienyl)methanone.

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