V023-4651 Screening compound: N-(2-{4-[(4-chlorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methylbutyl)benzamide

V023-4651 Screening compound: N-(2-{4-[(4-chlorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methylbutyl)benzamide
V023-4651 Screening compound: N-(2-{4-[(4-chlorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methylbutyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-4651
N-(2-{4-[(4-chlorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methylbutyl)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

V023-4651

Molecular Formula

C28H30ClFN2O3S (C28 H30 ClFN2 O3 S)

Compound Name

N-(2-{4-[(4-chlorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methylbutyl)benzamide

IUPAC name

N-(2-{4-[(4-chlorophenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methylbutyl)benzamide

SMILES

CC(C)CCN(CC(N(CC1)C(COc(cc2)ccc2Cl)c2c1scc2)=O)C(c1cc(F)ccc1)=O

InChI

InChI=1S/C28H30ClFN2O3S/c1-19(2)10-13-31(28(34)20-4-3-5-22(30)16-20)17-27(33)32-14-11-26-24(12-15-36-26)25(32)18-35-23-8-6-21(29)7-9-23/h3-9,12,15-16,19,25H,10-11,13-14,17-18H2,1-2H3/t25-/m0/s1

InChI Key

ZTIUQFKQXLWMJQ-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19864964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

529.08

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.222

Distribution Coefficient, logD

6.222

Water Solubility, LogSw

-6.32

Polar Surface Area

40.265

Acid Dissociation Constant (pKa)

22.36

Base Dissociation Constant (pKb)

2.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.71

V023-4651 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V023-4651 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-4651?
Check Price and Availability of V023-4651, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V023-4651 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-4651
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-4651
  • 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 V023-4651 available by request