Y501-2864 Screening compound: 2,6-bis[(E)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-1-cyclohexanone

Y501-2864 Screening compound: 2,6-bis[(E)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-1-cyclohexanone
Y501-2864 Screening compound: 2,6-bis[(E)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-1-cyclohexanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-2864
2,6-bis[(E)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-1-cyclohexanone

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

Y501-2864

Molecular Formula

C20H26N4O (C20 H26 N4 O)

Compound Name

2,6-bis[(E)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-1-cyclohexanone

IUPAC name

(2E6E)-26-bis[(135-trimethyl-1H-pyrazol-4-yl)methylidene]cyclohexan-1-one

SMILES

Cc1c(/C=C(\CCC/C2=C\c3c(C)n(C)nc3C)/C2=O)c(C)nn1C

InChI

InChI=1S/C20H26N4O/c1-12-18(14(3)23(5)21-12)10-16-8-7-9-17(20(16)25)11-19-13(2)22-24(6)15(19)4/h10-11H,7-9H2,1-6H3

InChI Key

YXGRBFUIUGRTAP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.007

Distribution Coefficient, logD

2.007

Water Solubility, LogSw

-1.88

Polar Surface Area

42.713

Acid Dissociation Constant (pKa)

27.39

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

References: we are preparing a list of scientific research reports with Y501-2864 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-2864?
Check Price and Availability of Y501-2864, 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 Y501-2864 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-2864
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-2864
  • 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 Y501-2864 available by request