V022-4440 Screening compound: 1-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxy-3-methoxypropyl)(3-methoxypropyl)amino]ethan-1-one

V022-4440 Screening compound: 1-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxy-3-methoxypropyl)(3-methoxypropyl)amino]ethan-1-one
V022-4440 Screening compound: 1-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxy-3-methoxypropyl)(3-methoxypropyl)amino]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-4440
1-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxy-3-methoxypropyl)(3-methoxypropyl)amino]ethan-1-one

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

V022-4440

Molecular Formula

C24H33FN2O5S (C24 H33 FN2 O5 S)

Compound Name

1-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-[(2-hydroxy-3-methoxypropyl)(3-methoxypropyl)amino]ethan-1-one

IUPAC name

1-{4-[(4-fluorophenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-[(2-hydroxy-3-methoxypropyl)(3-methoxypropyl)amino]ethan-1-one

SMILES

COCCCN(CC(COC)O)CC(N(CC1)C(COc(cc2)ccc2F)c2c1scc2)=O

InChI

InChI=1S/C24H33FN2O5S/c1-30-12-3-10-26(14-19(28)16-31-2)15-24(29)27-11-8-23-21(9-13-33-23)22(27)17-32-20-6-4-18(25)5-7-20/h4-7,9,13,19,22,28H,3,8,10-12,14-17H2,1-2H3

InChI Key

LGJTUMUMIQFOKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19882655

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

480.6

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.866

Distribution Coefficient, logD

2.864

Water Solubility, LogSw

-3.10

Polar Surface Area

61.423

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

5.14

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

54.20

V022-4440 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V022-4440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-4440?
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What is the minimum amount of V022-4440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-4440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-4440
  • 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 V022-4440 available by request