V029-9816 Screening compound: 2-bromo-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

V029-9816 Screening compound: 2-bromo-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
V029-9816 Screening compound: 2-bromo-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-9816
2-bromo-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

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

V029-9816

Molecular Formula

C16H13BrFNO2 (C16 H13 BrFNO2)

Compound Name

2-bromo-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

IUPAC name

2-bromo-N-[(5-fluoro-23-dihydro-1-benzofuran-2-yl)methyl]benzamide

SMILES

O=C(c(cccc1)c1Br)NCC(C1)Oc(cc2)c1cc2F

InChI

InChI=1S/C16H13BrFNO2/c17-14-4-2-1-3-13(14)16(20)19-9-12-8-10-7-11(18)5-6-15(10)21-12/h1-7,12H,8-9H2,(H,19,20)/t12-/m1/s1

InChI Key

WSQLQHQWSPFLJI-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD19952331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.19

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.536

Distribution Coefficient, logD

3.536

Water Solubility, LogSw

-3.78

Polar Surface Area

32.248

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

-4.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.80

V029-9816 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V029-9816 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-9816?
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What is the minimum amount of V029-9816 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-9816
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-9816
  • 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 V029-9816 available by request