V021-9926 Screening compound: 4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide

V021-9926 Screening compound: 4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide
V021-9926 Screening compound: 4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-9926
4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-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

V021-9926

Molecular Formula

C26H28ClFN2O5S2 (C26 H28 ClFN2 O5 S2)

Compound Name

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

IUPAC name

4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide

SMILES

COCCCN(CC(N(CC1)C(COc(cc2)ccc2F)c2c1scc2)=O)S(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C26H28ClFN2O5S2/c1-34-15-2-13-29(37(32,33)22-9-3-19(27)4-10-22)17-26(31)30-14-11-25-23(12-16-36-25)24(30)18-35-21-7-5-20(28)6-8-21/h3-10,12,16,24H,2,11,13-15,17-18H2,1H3/t24-/m0/s1

InChI Key

LGLWEKMTDRGTOI-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19867998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

567.1

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.027

Distribution Coefficient, logD

5.027

Water Solubility, LogSw

-4.92

Polar Surface Area

63.771

Acid Dissociation Constant (pKa)

22.76

Base Dissociation Constant (pKb)

-1.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with V021-9926 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-9926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-9926
  • 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 V021-9926 available by request