3825-7072 Screening compound: 5-chloro-N-(3,4-dimethoxyphenyl)-2-(phenylamino)benzamide

3825-7072 Screening compound: 5-chloro-N-(3,4-dimethoxyphenyl)-2-(phenylamino)benzamide
3825-7072 Screening compound: 5-chloro-N-(3,4-dimethoxyphenyl)-2-(phenylamino)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3825-7072
5-chloro-N-(3,4-dimethoxyphenyl)-2-(phenylamino)benzamide

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

3825-7072

Molecular Formula

C21H19ClN2O3 (C21 H19 ClN2 O3)

Compound Name

5-chloro-N-(3,4-dimethoxyphenyl)-2-(phenylamino)benzamide

IUPAC name

5-chloro-N-(34-dimethoxyphenyl)-2-(phenylamino)benzamide

SMILES

COc(ccc(NC(c(cc(cc1)Cl)c1Nc1ccccc1)=O)c1)c1OC

InChI

InChI=1S/C21H19ClN2O3/c1-26-19-11-9-16(13-20(19)27-2)24-21(25)17-12-14(22)8-10-18(17)23-15-6-4-3-5-7-15/h3-13,23H,1-2H3,(H,24,25)

InChI Key

LKIXDEICWJUEGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04062371

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.85

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.931

Distribution Coefficient, logD

4.931

Water Solubility, LogSw

-4.98

Polar Surface Area

46.805

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

3825-7072 in Drug Discovery

Included in Screening Libraries

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

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3825-7072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3825-7072?
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What is the minimum amount of 3825-7072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3825-7072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3825-7072
  • 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 3825-7072 available by request