D629-0094 Screening compound: N-(3-chloro-4-fluorophenyl)-2-[2-(phenoxymethyl)-1,3-thiazol-4-yl]acetamide

D629-0094 Screening compound: N-(3-chloro-4-fluorophenyl)-2-[2-(phenoxymethyl)-1,3-thiazol-4-yl]acetamide
D629-0094 Screening compound: N-(3-chloro-4-fluorophenyl)-2-[2-(phenoxymethyl)-1,3-thiazol-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D629-0094
N-(3-chloro-4-fluorophenyl)-2-[2-(phenoxymethyl)-1,3-thiazol-4-yl]acetamide

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

D629-0094

Molecular Formula

C18H14ClFN2O2S (C18 H14 ClFN2 O2 S)

Compound Name

N-(3-chloro-4-fluorophenyl)-2-[2-(phenoxymethyl)-1,3-thiazol-4-yl]acetamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-2-[2-(phenoxymethyl)-13-thiazol-4-yl]acetamide

SMILES

O=C(Cc1csc(COc2ccccc2)n1)Nc(cc1)cc(Cl)c1F

InChI

InChI=1S/C18H14ClFN2O2S/c19-15-8-12(6-7-16(15)20)21-17(23)9-13-11-25-18(22-13)10-24-14-4-2-1-3-5-14/h1-8,11H,9-10H2,(H,21,23)

InChI Key

UPTGKFIWAWZQBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15142366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.655

Distribution Coefficient, logD

4.640

Water Solubility, LogSw

-4.94

Polar Surface Area

41.340

Acid Dissociation Constant (pKa)

8.86

Base Dissociation Constant (pKb)

-2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

D629-0094 in Drug Discovery

Included in Screening Libraries

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D629-0094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D629-0094?
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What is the minimum amount of D629-0094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D629-0094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D629-0094
  • 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 D629-0094 available by request