V026-8141 Screening compound: 2,2-dimethyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]propanamide

V026-8141 Screening compound: 2,2-dimethyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]propanamide
V026-8141 Screening compound: 2,2-dimethyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-8141
2,2-dimethyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]propanamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V026-8141

Molecular Formula

C20H23NO3 (C20 H23 NO3)

Compound Name

2,2-dimethyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]propanamide

IUPAC name

22-dimethyl-N-[(5-phenoxy-23-dihydro-1-benzofuran-2-yl)methyl]propanamide

SMILES

CC(C)(C)C(NCC(C1)Oc(cc2)c1cc2Oc1ccccc1)=O

InChI

InChI=1S/C20H23NO3/c1-20(2,3)19(22)21-13-17-12-14-11-16(9-10-18(14)24-17)23-15-7-5-4-6-8-15/h4-11,17H,12-13H2,1-3H3,(H,21,22)/t17-/m1/s1

InChI Key

ZPLPMMCCUMIXKY-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD19952365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.135

Distribution Coefficient, logD

4.135

Water Solubility, LogSw

-4.39

Polar Surface Area

39.267

Acid Dissociation Constant (pKa)

14.03

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

V026-8141 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Cardiovascular Library (22201 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V026-8141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-8141?
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What is the minimum amount of V026-8141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-8141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-8141
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V026-8141 available by request