F052-0478 Screening compound: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-6-[(4-methylpiperidin-1-yl)sulfonyl]quinoline

F052-0478 Screening compound: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-6-[(4-methylpiperidin-1-yl)sulfonyl]quinoline
F052-0478 Screening compound: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-6-[(4-methylpiperidin-1-yl)sulfonyl]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound F052-0478
2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-6-[(4-methylpiperidin-1-yl)sulfonyl]quinoline

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

F052-0478

Molecular Formula

C26H31ClN4O2S (C26 H31 ClN4 O2 S)

Compound Name

2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-6-[(4-methylpiperidin-1-yl)sulfonyl]quinoline

IUPAC name

2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-6-[(4-methylpiperidin-1-yl)sulfonyl]quinoline

SMILES

CC(CC1)CCN1S(c(cc1cc2)ccc1nc2N(CC1)CCN1c1c(C)ccc(Cl)c1)(=O)=O

InChI

InChI=1S/C26H31ClN4O2S/c1-19-9-11-31(12-10-19)34(32,33)23-6-7-24-21(17-23)4-8-26(28-24)30-15-13-29(14-16-30)25-18-22(27)5-3-20(25)2/h3-8,17-19H,9-16H2,1-2H3

InChI Key

OUMWKBLZKAZFLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938246

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.08

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.440

Distribution Coefficient, logD

6.440

Water Solubility, LogSw

-6.47

Polar Surface Area

46.155

Acid Dissociation Constant (pKa)

24.01

Base Dissociation Constant (pKb)

3.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

F052-0478 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with F052-0478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F052-0478?
Check Price and Availability of F052-0478, 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 F052-0478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F052-0478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F052-0478
  • 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 F052-0478 available by request