8006-3933 Screening compound: N-[4-(propan-2-yl)phenyl]-2-{[4-({4-[({[4-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]phenyl}sulfanyl)phenyl]sulfanyl}acetamide

8006-3933 Screening compound: N-[4-(propan-2-yl)phenyl]-2-{[4-({4-[({[4-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]phenyl}sulfanyl)phenyl]sulfanyl}acetamide
8006-3933 Screening compound: N-[4-(propan-2-yl)phenyl]-2-{[4-({4-[({[4-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]phenyl}sulfanyl)phenyl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-3933
N-[4-(propan-2-yl)phenyl]-2-{[4-({4-[({[4-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]phenyl}sulfanyl)phenyl]sulfanyl}acetamide

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

8006-3933

Molecular Formula

C34H36N2O2S3 (C34 H36 N2 O2 S3)

Compound Name

N-[4-(propan-2-yl)phenyl]-2-{[4-({4-[({[4-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]phenyl}sulfanyl)phenyl]sulfanyl}acetamide

IUPAC name

N-[4-(propan-2-yl)phenyl]-2-{[4-({4-[({[4-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]phenyl}sulfanyl)phenyl]sulfanyl}acetamide

SMILES

CC(C)c(cc1)ccc1NC(CSc(cc1)ccc1Sc(cc1)ccc1SCC(Nc1ccc(C(C)C)cc1)=O)=O

InChI

InChI=1S/C34H36N2O2S3/c1-23(2)25-5-9-27(10-6-25)35-33(37)21-39-29-13-17-31(18-14-29)41-32-19-15-30(16-20-32)40-22-34(38)36-28-11-7-26(8-12-28)24(3)4/h5-20,23-24H,21-22H2,1-4H3,(H,35,37)(H,36,38)

InChI Key

XINGHIWGBOUELD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00716665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

600.87

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

9.750

Distribution Coefficient, logD

9.750

Water Solubility, LogSw

-5.84

Polar Surface Area

45.722

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

8006-3933 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8006-3933 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-3933?
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What is the minimum amount of 8006-3933 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-3933
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-3933
  • 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 8006-3933 available by request