Y501-3263 Screening compound: ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl}methyl)-2-(ethylamino)-1,3-thiazole-5-carboxylate

Y501-3263 Screening compound: ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl}methyl)-2-(ethylamino)-1,3-thiazole-5-carboxylate
Y501-3263 Screening compound: ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl}methyl)-2-(ethylamino)-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-3263
ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl}methyl)-2-(ethylamino)-1,3-thiazole-5-carboxylate

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

Y501-3263

Molecular Formula

C17H17F3N4O2S2 (C17 H17 F3 N4 O2 S2)

Compound Name

ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl}methyl)-2-(ethylamino)-1,3-thiazole-5-carboxylate

IUPAC name

ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-2-(ethylamino)-13-thiazole-5-carboxylate

SMILES

CCNc1nc(CSc2nc(C(F)(F)F)cc(C)c2C#N)c(C(OCC)=O)s1

InChI

InChI=1S/C17H17F3N4O2S2/c1-4-22-16-23-11(13(28-16)15(25)26-5-2)8-27-14-10(7-21)9(3)6-12(24-14)17(18,19)20/h6H,4-5,8H2,1-3H3,(H,22,23)

InChI Key

DHOHSAVSCBHNFH-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.872

Distribution Coefficient, logD

4.872

Water Solubility, LogSw

-4.69

Polar Surface Area

67.968

Acid Dissociation Constant (pKa)

17.40

Base Dissociation Constant (pKb)

2.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

References: we are preparing a list of scientific research reports with Y501-3263 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-3263?
Check Price and Availability of Y501-3263, 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 Y501-3263 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-3263
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-3263
  • 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 Y501-3263 available by request