V023-5947 Screening compound: N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)-3-methylbutanamide

V023-5947 Screening compound: N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)-3-methylbutanamide
V023-5947 Screening compound: N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-5947
N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)-3-methylbutanamide

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

V023-5947

Molecular Formula

C25H33FN2O4S (C25 H33 FN2 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CC(N(CCCOC)CC(N(CC1)C(COc(cccc2)c2F)c2c1scc2)=O)=O

InChI

InChI=1S/C25H33FN2O4S/c1-18(2)15-24(29)27(11-6-13-31-3)16-25(30)28-12-9-23-19(10-14-33-23)21(28)17-32-22-8-5-4-7-20(22)26/h4-5,7-8,10,14,18,21H,6,9,11-13,15-17H2,1-3H3/t21-/m0/s1

InChI Key

KGBWWURCIHKUQS-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19866600

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.61

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.467

Distribution Coefficient, logD

4.467

Water Solubility, LogSw

-4.25

Polar Surface Area

48.438

Acid Dissociation Constant (pKa)

24.23

Base Dissociation Constant (pKb)

0.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with V023-5947 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V023-5947 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-5947
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-5947
  • 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 V023-5947 available by request