L161-0102 Screening compound: [4-(4-fluorophenyl)piperazino]{6-[(2-piperidinoethyl)sulfanyl]-3-pyridyl}methanone

L161-0102 Screening compound: [4-(4-fluorophenyl)piperazino]{6-[(2-piperidinoethyl)sulfanyl]-3-pyridyl}methanone
L161-0102 Screening compound: [4-(4-fluorophenyl)piperazino]{6-[(2-piperidinoethyl)sulfanyl]-3-pyridyl}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound L161-0102
[4-(4-fluorophenyl)piperazino]{6-[(2-piperidinoethyl)sulfanyl]-3-pyridyl}methanone

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

L161-0102

Molecular Formula

C23H29FN4OS (C23 H29 FN4 OS)

Compound Name

[4-(4-fluorophenyl)piperazino]{6-[(2-piperidinoethyl)sulfanyl]-3-pyridyl}methanone

IUPAC name

1-(4-fluorophenyl)-4-(6-{[2-(piperidin-1-yl)ethyl]sulfanyl}pyridine-3-carbonyl)piperazine

SMILES

O=C(c(cc1)cnc1SCCN1CCCCC1)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C23H29FN4OS/c24-20-5-7-21(8-6-20)27-12-14-28(15-13-27)23(29)19-4-9-22(25-18-19)30-17-16-26-10-2-1-3-11-26/h4-9,18H,1-3,10-17H2

InChI Key

ABTHTQFGKUZMMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15119856

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.270

Distribution Coefficient, logD

1.851

Water Solubility, LogSw

-3.19

Polar Surface Area

32.356

Acid Dissociation Constant (pKa)

27.26

Base Dissociation Constant (pKb)

8.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.83

References: we are preparing a list of scientific research reports with L161-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L161-0102?
Check Price and Availability of L161-0102, 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 L161-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L161-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L161-0102
  • 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 L161-0102 available by request