8003-0674 Screening compound: 4-[2-(4-{[(3,4-dichlorophenyl)carbamoyl]oxy}phenyl)propan-2-yl]phenyl N-(3,4-dichlorophenyl)carbamate

8003-0674 Screening compound: 4-[2-(4-{[(3,4-dichlorophenyl)carbamoyl]oxy}phenyl)propan-2-yl]phenyl N-(3,4-dichlorophenyl)carbamate
8003-0674 Screening compound: 4-[2-(4-{[(3,4-dichlorophenyl)carbamoyl]oxy}phenyl)propan-2-yl]phenyl N-(3,4-dichlorophenyl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-0674
4-[2-(4-{[(3,4-dichlorophenyl)carbamoyl]oxy}phenyl)propan-2-yl]phenyl N-(3,4-dichlorophenyl)carbamate

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

8003-0674

Molecular Formula

C29H22Cl4N2O4 (C29 H22 Cl4 N2 O4)

Compound Name

4-[2-(4-{[(3,4-dichlorophenyl)carbamoyl]oxy}phenyl)propan-2-yl]phenyl N-(3,4-dichlorophenyl)carbamate

IUPAC name

4-[2-(4-{[(34-dichlorophenyl)carbamoyl]oxy}phenyl)propan-2-yl]phenyl N-(34-dichlorophenyl)carbamate

SMILES

CC(C)(c(cc1)ccc1OC(Nc(cc1)cc(Cl)c1Cl)=O)c(cc1)ccc1OC(Nc(cc1)cc(Cl)c1Cl)=O

InChI

InChI=1S/C29H22Cl4N2O4/c1-29(2,17-3-9-21(10-4-17)38-27(36)34-19-7-13-23(30)25(32)15-19)18-5-11-22(12-6-18)39-28(37)35-20-8-14-24(31)26(33)16-20/h3-16H,1-2H3,(H,34,36)(H,35,37)

InChI Key

YDMKHMXIENHLPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00742814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

604.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

10.275

Distribution Coefficient, logD

10.184

Water Solubility, LogSw

-6.72

Polar Surface Area

62.103

Acid Dissociation Constant (pKa)

8.03

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.34

8003-0674 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8003-0674 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-0674?
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What is the minimum amount of 8003-0674 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-0674
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-0674
  • 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 8003-0674 available by request