V028-8553 Screening compound: 2-{4-[(3,4-difluorobenzyl)oxy]-3-methoxyphenyl}-N-(3-methoxyphenyl)-1,3-thiazole-4-carboxamide

V028-8553 Screening compound: 2-{4-[(3,4-difluorobenzyl)oxy]-3-methoxyphenyl}-N-(3-methoxyphenyl)-1,3-thiazole-4-carboxamide
V028-8553 Screening compound: 2-{4-[(3,4-difluorobenzyl)oxy]-3-methoxyphenyl}-N-(3-methoxyphenyl)-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-8553
2-{4-[(3,4-difluorobenzyl)oxy]-3-methoxyphenyl}-N-(3-methoxyphenyl)-1,3-thiazole-4-carboxamide

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

V028-8553

Molecular Formula

C25H20F2N2O4S (C25 H20 F2 N2 O4 S)

Compound Name

2-{4-[(3,4-difluorobenzyl)oxy]-3-methoxyphenyl}-N-(3-methoxyphenyl)-1,3-thiazole-4-carboxamide

IUPAC name

2-{4-[(34-difluorophenyl)methoxy]-3-methoxyphenyl}-N-(3-methoxyphenyl)-13-thiazole-4-carboxamide

SMILES

COc1cccc(NC(c2csc(-c(cc3)cc(OC)c3OCc(cc3)cc(F)c3F)n2)=O)c1

InChI

InChI=1S/C25H20F2N2O4S/c1-31-18-5-3-4-17(12-18)28-24(30)21-14-34-25(29-21)16-7-9-22(23(11-16)32-2)33-13-15-6-8-19(26)20(27)10-15/h3-12,14H,13H2,1-2H3,(H,28,30)

InChI Key

HVKUBPXDOAYRLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19925880

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

482.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.795

Distribution Coefficient, logD

5.795

Water Solubility, LogSw

-5.57

Polar Surface Area

55.552

Acid Dissociation Constant (pKa)

11.57

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

References: we are preparing a list of scientific research reports with V028-8553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-8553?
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What is the minimum amount of V028-8553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-8553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-8553
  • 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 V028-8553 available by request