Y501-4372 Screening compound: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2,2,3,3,4,4,5,5,5-nonafluoropentanamide

Y501-4372 Screening compound: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2,2,3,3,4,4,5,5,5-nonafluoropentanamide
Y501-4372 Screening compound: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2,2,3,3,4,4,5,5,5-nonafluoropentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-4372
N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2,2,3,3,4,4,5,5,5-nonafluoropentanamide

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

Y501-4372

Molecular Formula

C13H9F9N2OS (C13 H9 F9 N2 OS)

Compound Name

N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2,2,3,3,4,4,5,5,5-nonafluoropentanamide

IUPAC name

N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-223344555-nonafluoropentanamide

SMILES

CCc1c(C)sc(NC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)=O)c1C#N

InChI

InChI=1S/C13H9F9N2OS/c1-3-6-5(2)26-8(7(6)4-23)24-9(25)10(14,15)11(16,17)12(18,19)13(20,21)22/h3H2,1-2H3,(H,24,25)

InChI Key

VTLZPABKCRQSJI-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.28

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.035

Distribution Coefficient, logD

0.910

Water Solubility, LogSw

-4.70

Polar Surface Area

40.452

Acid Dissociation Constant (pKa)

3.28

Base Dissociation Constant (pKb)

-6.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.85

References: we are preparing a list of scientific research reports with Y501-4372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-4372?
Check Price and Availability of Y501-4372, 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 Y501-4372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-4372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-4372
  • 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 Y501-4372 available by request