C274-8358 Screening compound: 4-[(3-{4-[(4-chlorophenyl)(phenyl)methyl]piperazine-1-carbonyl}piperidin-1-yl)sulfonyl]-2,1,3-benzoxadiazole

C274-8358 Screening compound: 4-[(3-{4-[(4-chlorophenyl)(phenyl)methyl]piperazine-1-carbonyl}piperidin-1-yl)sulfonyl]-2,1,3-benzoxadiazole
C274-8358 Screening compound: 4-[(3-{4-[(4-chlorophenyl)(phenyl)methyl]piperazine-1-carbonyl}piperidin-1-yl)sulfonyl]-2,1,3-benzoxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C274-8358
4-[(3-{4-[(4-chlorophenyl)(phenyl)methyl]piperazine-1-carbonyl}piperidin-1-yl)sulfonyl]-2,1,3-benzoxadiazole

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

C274-8358

Molecular Formula

C29H30ClN5O4S (C29 H30 ClN5 O4 S)

Compound Name

4-[(3-{4-[(4-chlorophenyl)(phenyl)methyl]piperazine-1-carbonyl}piperidin-1-yl)sulfonyl]-2,1,3-benzoxadiazole

IUPAC name

4-[(3-{4-[(4-chlorophenyl)(phenyl)methyl]piperazine-1-carbonyl}piperidin-1-yl)sulfonyl]-213-benzoxadiazole

SMILES

O=C(C(CCC1)CN1S(c1cccc2nonc12)(=O)=O)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl

InChI

InChI=1S/C29H30ClN5O4S/c30-24-13-11-22(12-14-24)28(21-6-2-1-3-7-21)33-16-18-34(19-17-33)29(36)23-8-5-15-35(20-23)40(37,38)26-10-4-9-25-27(26)32-39-31-25/h1-4,6-7,9-14,23,28H,5,8,15-20H2

InChI Key

KYLPZCPVDXYCCX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14740499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

580.11

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.005

Distribution Coefficient, logD

5.003

Water Solubility, LogSw

-5.45

Polar Surface Area

87.182

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

4.96

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

34.50

C274-8358 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C274-8358 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C274-8358?
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What is the minimum amount of C274-8358 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C274-8358
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C274-8358
  • 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 C274-8358 available by request