Y041-3349 Screening compound: 4-{4-methyl-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carbonyl}piperazine-1-carbaldehyde

Y041-3349 Screening compound: 4-{4-methyl-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carbonyl}piperazine-1-carbaldehyde
Y041-3349 Screening compound: 4-{4-methyl-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carbonyl}piperazine-1-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-3349
4-{4-methyl-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carbonyl}piperazine-1-carbaldehyde

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

Y041-3349

Molecular Formula

C17H16F3N3O3S (C17 H16 F3 N3 O3 S)

Compound Name

4-{4-methyl-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carbonyl}piperazine-1-carbaldehyde

IUPAC name

4-{4-methyl-2-[4-(trifluoromethoxy)phenyl]-13-thiazole-5-carbonyl}piperazine-1-carbaldehyde

SMILES

Cc1c(C(N(CC2)CCN2C=O)=O)sc(-c(cc2)ccc2OC(F)(F)F)n1

InChI

InChI=1S/C17H16F3N3O3S/c1-11-14(16(25)23-8-6-22(10-24)7-9-23)27-15(21-11)12-2-4-13(5-3-12)26-17(18,19)20/h2-5,10H,6-9H2,1H3

InChI Key

OPSYSCNKKVXKNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12203750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.105

Distribution Coefficient, logD

3.105

Water Solubility, LogSw

-3.18

Polar Surface Area

50.603

Acid Dissociation Constant (pKa)

29.00

Base Dissociation Constant (pKb)

1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

Y041-3349 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular

References: we are preparing a list of scientific research reports with Y041-3349 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-3349?
Check Price and Availability of Y041-3349, 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 Y041-3349 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-3349
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-3349
  • 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 Y041-3349 available by request