8003-2493 Screening compound: 1,2-dimethyl-4-({3-[(2-toluidinocarbothioyl)oxy]benzoyl}amino)benzene

8003-2493 Screening compound: 1,2-dimethyl-4-({3-[(2-toluidinocarbothioyl)oxy]benzoyl}amino)benzene
8003-2493 Screening compound: 1,2-dimethyl-4-({3-[(2-toluidinocarbothioyl)oxy]benzoyl}amino)benzene alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-2493
1,2-dimethyl-4-({3-[(2-toluidinocarbothioyl)oxy]benzoyl}amino)benzene

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

8003-2493

Molecular Formula

C23H22N2O2S (C23 H22 N2 O2 S)

Compound Name

1,2-dimethyl-4-({3-[(2-toluidinocarbothioyl)oxy]benzoyl}amino)benzene

IUPAC name

N-(34-dimethylphenyl)-3-{[(2-methylphenyl)carbamothioyl]oxy}benzamide

SMILES

Cc(cc1)c(C)cc1NC(c1cccc(OC(Nc2c(C)cccc2)=S)c1)=O

InChI

InChI=1S/C23H22N2O2S/c1-15-11-12-19(13-17(15)3)24-22(26)18-8-6-9-20(14-18)27-23(28)25-21-10-5-4-7-16(21)2/h4-14H,1-3H3,(H,24,26)(H,25,28)

InChI Key

VENPYDWVNMXIHG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00743350

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.840

Distribution Coefficient, logD

5.839

Water Solubility, LogSw

-5.58

Polar Surface Area

39.671

Acid Dissociation Constant (pKa)

10.68

Base Dissociation Constant (pKb)

1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.04

References: we are preparing a list of scientific research reports with 8003-2493 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-2493?
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What is the minimum amount of 8003-2493 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-2493
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-2493
  • 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 8003-2493 available by request