BRN 0564746

methyl 2-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-6-methyl-3-propan-2-ylbenzoate

CAS: 53206-85-2

Molecular Formula	`C20H32N2O4`
Molecular Weight	364.5 g/mol
LogP	2.5
Topological Polar Surface Area	62.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	364.2362
Heavy Atoms	26
Complexity	438.0

Chemical Identifiers

CAS Number	53206-85-2
SMILES	`CC1=C(C(=C(C=C1)C(C)C)OCC(CN2CCN(CC2)C)O)C(=O)OC`
InChIKey	`XILVKGHOXYREOY-UHFFFAOYSA-N`

📖 Product Overview

BRN 0564746 (CAS: 53206-85-2) is a chemical compound with molecular formula C20H32N2O4 and molecular weight 364.5 g/mol. Its IUPAC systematic name is methyl 2-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-6-methyl-3-propan-2-ylbenzoate. LogP 2.5 Topological Polar Surface Area 62.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 8 Exact Mass 364.2362 Heavy Atoms 26 Complexity 438.0 InChI Key: XILVKGHOXYREOY-UHFFFAOYSA-N. SMILES: CC1=C(C(=C(C=C1)C(C)C)OCC(CN2CCN(CC2)C)O)C(=O)OC.

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