Y041-3102 Screening compound: N-[(pyridin-3-yl)methyl]-2-{2-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-4-yl}acetamide

Y041-3102 Screening compound: N-[(pyridin-3-yl)methyl]-2-{2-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-4-yl}acetamide
Y041-3102 Screening compound: N-[(pyridin-3-yl)methyl]-2-{2-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-3102
N-[(pyridin-3-yl)methyl]-2-{2-[4-(trifluoromethoxy)phenyl]-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

Y041-3102

Molecular Formula

C18H14F3N3O2S (C18 H14 F3 N3 O2 S)

Compound Name

N-[(pyridin-3-yl)methyl]-2-{2-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-4-yl}acetamide

IUPAC name

N-[(pyridin-3-yl)methyl]-2-{2-[4-(trifluoromethoxy)phenyl]-13-thiazol-4-yl}acetamide

SMILES

O=C(Cc1csc(-c(cc2)ccc2OC(F)(F)F)n1)NCc1cnccc1

InChI

InChI=1S/C18H14F3N3O2S/c19-18(20,21)26-15-5-3-13(4-6-15)17-24-14(11-27-17)8-16(25)23-10-12-2-1-7-22-9-12/h1-7,9,11H,8,10H2,(H,23,25)

InChI Key

GQVBVDMLYUIQPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10042065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.850

Distribution Coefficient, logD

3.847

Water Solubility, LogSw

-3.99

Polar Surface Area

50.122

Acid Dissociation Constant (pKa)

13.91

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

Y041-3102 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with Y041-3102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-3102?
Check Price and Availability of Y041-3102, 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 Y041-3102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-3102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-3102
  • 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 Y041-3102 available by request