V016-9125 Screening compound: N-(propan-2-yl)-2-(3-{[4-(trifluoromethyl)phenyl]methoxy}phenyl)-1,3-thiazole-4-carboxamide

V016-9125 Screening compound: N-(propan-2-yl)-2-(3-{[4-(trifluoromethyl)phenyl]methoxy}phenyl)-1,3-thiazole-4-carboxamide
V016-9125 Screening compound: N-(propan-2-yl)-2-(3-{[4-(trifluoromethyl)phenyl]methoxy}phenyl)-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-9125
N-(propan-2-yl)-2-(3-{[4-(trifluoromethyl)phenyl]methoxy}phenyl)-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

V016-9125

Molecular Formula

C21H19F3N2O2S (C21 H19 F3 N2 O2 S)

Compound Name

N-(propan-2-yl)-2-(3-{[4-(trifluoromethyl)phenyl]methoxy}phenyl)-1,3-thiazole-4-carboxamide

IUPAC name

N-(propan-2-yl)-2-(3-{[4-(trifluoromethyl)phenyl]methoxy}phenyl)-13-thiazole-4-carboxamide

SMILES

CC(C)NC(c1csc(-c2cc(OCc3ccc(C(F)(F)F)cc3)ccc2)n1)=O

InChI

InChI=1S/C21H19F3N2O2S/c1-13(2)25-19(27)18-12-29-20(26-18)15-4-3-5-17(10-15)28-11-14-6-8-16(9-7-14)21(22,23)24/h3-10,12-13H,11H2,1-2H3,(H,25,27)

InChI Key

BDDODNCMELDMDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19926019

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.509

Distribution Coefficient, logD

5.509

Water Solubility, LogSw

-5.52

Polar Surface Area

40.859

Acid Dissociation Constant (pKa)

15.36

Base Dissociation Constant (pKb)

-1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

V016-9125 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V016-9125 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-9125?
Check Price and Availability of V016-9125, 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 V016-9125 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-9125
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-9125
  • 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 V016-9125 available by request