D475-0087 Screening compound: 2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

D475-0087 Screening compound: 2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
D475-0087 Screening compound: 2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D475-0087
2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-N-[3-(trifluoromethyl)phenyl]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

D475-0087

Molecular Formula

C22H17F3N4O2S (C22 H17 F3 N4 O2 S)

Compound Name

2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

IUPAC name

2-[5-hydroxy-3-methyl-1-(4-phenyl-13-thiazol-2-yl)-1H-pyrazol-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

SMILES

Cc(c(CC(Nc1cc(C(F)(F)F)ccc1)=O)c1O)nn1-c1nc(-c2ccccc2)cs1

InChI

InChI=1S/C22H17F3N4O2S/c1-13-17(11-19(30)26-16-9-5-8-15(10-16)22(23,24)25)20(31)29(28-13)21-27-18(12-32-21)14-6-3-2-4-7-14/h2-10,12,31H,11H2,1H3,(H,26,30)

InChI Key

IGOUTKPXFZRCES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14830900

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.185

Distribution Coefficient, logD

2.695

Water Solubility, LogSw

-4.96

Polar Surface Area

62.515

Acid Dissociation Constant (pKa)

5.41

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

D475-0087 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with D475-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D475-0087?
Check Price and Availability of D475-0087, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D475-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D475-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D475-0087
  • 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 D475-0087 available by request