Compound C25H31NO6

4-[3-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylethoxy)-1-benzofuran-5-yl]-3-hydroxypropyl]phenol

CAS: 40681-00-3

Molecular Formula	`C25H31NO6`
Molecular Weight	441.5 g/mol
LogP	3.9
Topological Polar Surface Area	84.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	10
Exact Mass	441.21515
Heavy Atoms	32
Complexity	551.0

Chemical Identifiers

CAS Number	40681-00-3
SMILES	`COC1=C(C(=C(C2=C1C=CO2)OC)OCCN3CCCC3)C(CCC4=CC=C(C=C4)O)O`
InChIKey	`JCINDSKUTAWEHY-UHFFFAOYSA-N`

📖 Product Overview

Compound C25H31NO6 (CAS: 40681-00-3) is a chemical compound with molecular formula C25H31NO6 and molecular weight 441.5 g/mol. Its IUPAC systematic name is 4-[3-[4,7-dimethoxy-6-(2-pyrrolidin-1-ylethoxy)-1-benzofuran-5-yl]-3-hydroxypropyl]phenol. LogP 3.9 Topological Polar Surface Area 84.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 7 Rotatable Bonds 10 Exact Mass 441.21515 Heavy Atoms 32 Complexity 551.0 InChI Key: JCINDSKUTAWEHY-UHFFFAOYSA-N. SMILES: COC1=C(C(=C(C2=C1C=CO2)OC)OCCN3CCCC3)C(CCC4=CC=C(C=C4)O)O.

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