Compound C31H37N3O3

3-phenyl-2-[(4-phenylpiperazin-1-yl)methyl]-4-(piperidin-1-ylmethyl)-1-benzofuran-5-ol;hydrate

CAS: 74229-23-5

Molecular Formula	`C31H37N3O3`
Molecular Weight	499.6 g/mol
Topological Polar Surface Area	44.1 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	499.28348
Heavy Atoms	37
Complexity	665.0

Chemical Identifiers

CAS Number	74229-23-5
SMILES	`C1CCN(CC1)CC2=C(C=CC3=C2C(=C(O3)CN4CCN(CC4)C5=CC=CC=C5)C6=CC=CC=C6)O.O`
InChIKey	`MRCTYZMQEDTVBP-UHFFFAOYSA-N`

📖 Product Overview

Compound C31H37N3O3 (CAS: 74229-23-5) is a chemical compound with molecular formula C31H37N3O3 and molecular weight 499.6 g/mol. Its IUPAC systematic name is 3-phenyl-2-[(4-phenylpiperazin-1-yl)methyl]-4-(piperidin-1-ylmethyl)-1-benzofuran-5-ol;hydrate. Topological Polar Surface Area 44.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 499.28348 Heavy Atoms 37 Complexity 665.0 InChI Key: MRCTYZMQEDTVBP-UHFFFAOYSA-N. SMILES: C1CCN(CC1)CC2=C(C=CC3=C2C(=C(O3)CN4CCN(CC4)C5=CC=CC=C5)C6=CC=CC=C6)O.O.

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