L064-0081 Screening compound: 5-{1-[2-(4-fluorophenoxy)acetyl]piperidin-3-yl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide

L064-0081 Screening compound: 5-{1-[2-(4-fluorophenoxy)acetyl]piperidin-3-yl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
L064-0081 Screening compound: 5-{1-[2-(4-fluorophenoxy)acetyl]piperidin-3-yl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L064-0081
5-{1-[2-(4-fluorophenoxy)acetyl]piperidin-3-yl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide

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

L064-0081

Molecular Formula

C22H20F2N4O3S (C22 H20 F2 N4 O3 S)

Compound Name

5-{1-[2-(4-fluorophenoxy)acetyl]piperidin-3-yl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-{1-[2-(4-fluorophenoxy)acetyl]piperidin-3-yl}-N-(4-fluorophenyl)-134-thiadiazole-2-carboxamide

SMILES

O=C(COc(cc1)ccc1F)N(CCC1)CC1c1nnc(C(Nc(cc2)ccc2F)=O)s1

InChI

InChI=1S/C22H20F2N4O3S/c23-15-3-7-17(8-4-15)25-20(30)22-27-26-21(32-22)14-2-1-11-28(12-14)19(29)13-31-18-9-5-16(24)6-10-18/h3-10,14H,1-2,11-13H2,(H,25,30)/t14-/m0/s1

InChI Key

GJBGVWVOALDYEI-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27228401

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.021

Distribution Coefficient, logD

3.018

Water Solubility, LogSw

-3.47

Polar Surface Area

70.116

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with L064-0081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L064-0081?
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What is the minimum amount of L064-0081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L064-0081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L064-0081
  • 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 L064-0081 available by request