V003-8422 Screening compound: 4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-propylbenzene-1-sulfonamide

V003-8422 Screening compound: 4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-propylbenzene-1-sulfonamide
V003-8422 Screening compound: 4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-propylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-8422
4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-propylbenzene-1-sulfonamide

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

V003-8422

Molecular Formula

C25H26ClFN2O4S2 (C25 H26 ClFN2 O4 S2)

Compound Name

4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-propylbenzene-1-sulfonamide

IUPAC name

4-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-N-propylbenzene-1-sulfonamide

SMILES

CCCN(CC(N(CC1)C(COc(cccc2)c2F)c2c1scc2)=O)S(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C25H26ClFN2O4S2/c1-2-13-28(35(31,32)19-9-7-18(26)8-10-19)16-25(30)29-14-11-24-20(12-15-34-24)22(29)17-33-23-6-4-3-5-21(23)27/h3-10,12,15,22H,2,11,13-14,16-17H2,1H3/t22-/m0/s1

InChI Key

NEWMEOJVTPBVJS-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19867953

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.08

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.841

Distribution Coefficient, logD

5.841

Water Solubility, LogSw

-5.97

Polar Surface Area

55.516

Acid Dissociation Constant (pKa)

22.76

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with V003-8422 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-8422?
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What is the minimum amount of V003-8422 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-8422
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-8422
  • 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 V003-8422 available by request