V023-5912 Screening compound: 3-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzamide

V023-5912 Screening compound: 3-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzamide
V023-5912 Screening compound: 3-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-5912
3-chloro-N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)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

V023-5912

Molecular Formula

C27H28ClFN2O4S (C27 H28 ClFN2 O4 S)

Compound Name

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

IUPAC name

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

SMILES

COCCCN(CC(N(CC1)C(COc(cccc2)c2F)c2c1scc2)=O)C(c1cccc(Cl)c1)=O

InChI

InChI=1S/C27H28ClFN2O4S/c1-34-14-5-12-30(27(33)19-6-4-7-20(28)16-19)17-26(32)31-13-10-25-21(11-15-36-25)23(31)18-35-24-9-3-2-8-22(24)29/h2-4,6-9,11,15-16,23H,5,10,12-14,17-18H2,1H3/t23-/m0/s1

InChI Key

UEWWZJFAXQIMKN-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19866612

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

531.05

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.997

Distribution Coefficient, logD

4.997

Water Solubility, LogSw

-5.08

Polar Surface Area

48.694

Acid Dissociation Constant (pKa)

22.36

Base Dissociation Constant (pKb)

-0.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V023-5912 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V023-5912 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-5912
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-5912
  • 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 V023-5912 available by request