Y041-5802 Screening compound: 4-(4-chlorophenyl)-1-[3-(2-chlorophenyl)-1-methyl-1H-pyrazole-5-carbonyl]piperidin-4-ol

Y041-5802 Screening compound: 4-(4-chlorophenyl)-1-[3-(2-chlorophenyl)-1-methyl-1H-pyrazole-5-carbonyl]piperidin-4-ol
Y041-5802 Screening compound: 4-(4-chlorophenyl)-1-[3-(2-chlorophenyl)-1-methyl-1H-pyrazole-5-carbonyl]piperidin-4-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-5802
4-(4-chlorophenyl)-1-[3-(2-chlorophenyl)-1-methyl-1H-pyrazole-5-carbonyl]piperidin-4-ol

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

Y041-5802

Molecular Formula

C22H21Cl2N3O2 (C22 H21 Cl2 N3 O2)

Compound Name

4-(4-chlorophenyl)-1-[3-(2-chlorophenyl)-1-methyl-1H-pyrazole-5-carbonyl]piperidin-4-ol

IUPAC name

4-(4-chlorophenyl)-1-[3-(2-chlorophenyl)-1-methyl-1H-pyrazole-5-carbonyl]piperidin-4-ol

SMILES

Cn(c(C(N(CC1)CCC1(c(cc1)ccc1Cl)O)=O)c1)nc1-c(cccc1)c1Cl

InChI

InChI=1S/C22H21Cl2N3O2/c1-26-20(14-19(25-26)17-4-2-3-5-18(17)24)21(28)27-12-10-22(29,11-13-27)15-6-8-16(23)9-7-15/h2-9,14,29H,10-13H2,1H3

InChI Key

KHJWFBYOXFUUSJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22585129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.795

Distribution Coefficient, logD

3.795

Water Solubility, LogSw

-4.11

Polar Surface Area

44.965

Acid Dissociation Constant (pKa)

15.21

Base Dissociation Constant (pKb)

0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

References: we are preparing a list of scientific research reports with Y041-5802 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-5802?
Check Price and Availability of Y041-5802, 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 Y041-5802 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-5802
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-5802
  • 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 Y041-5802 available by request