D030-1020 Screening compound: 4-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]cyclohexyl}benzene-1-sulfonamide

D030-1020 Screening compound: 4-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]cyclohexyl}benzene-1-sulfonamide
D030-1020 Screening compound: 4-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]cyclohexyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D030-1020
4-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]cyclohexyl}benzene-1-sulfonamide

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

D030-1020

Molecular Formula

C22H27ClFN3O2S (C22 H27 ClFN3 O2 S)

Compound Name

4-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]cyclohexyl}benzene-1-sulfonamide

IUPAC name

4-chloro-N-{2-[4-(4-fluorophenyl)piperazin-1-yl]cyclohexyl}benzene-1-sulfonamide

SMILES

O=S(c(cc1)ccc1Cl)(NC(CCCC1)C1N(CC1)CCN1c(cc1)ccc1F)=O

InChI

InChI=1S/C22H27ClFN3O2S/c23-17-5-11-20(12-6-17)30(28,29)25-21-3-1-2-4-22(21)27-15-13-26(14-16-27)19-9-7-18(24)8-10-19/h5-12,21-22,25H,1-4,13-16H2

InChI Key

QQYNBGDRAKCUCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.99

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.634

Distribution Coefficient, logD

4.622

Water Solubility, LogSw

-4.89

Polar Surface Area

48.145

Acid Dissociation Constant (pKa)

11.71

Base Dissociation Constant (pKb)

5.86

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

45.50

D030-1020 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Autophagy-Targeted Library (4564 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with D030-1020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D030-1020?
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What is the minimum amount of D030-1020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D030-1020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D030-1020
  • 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 D030-1020 available by request