3807-5864 Screening compound: 3-bromo-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylbenzamide

3807-5864 Screening compound: 3-bromo-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylbenzamide
3807-5864 Screening compound: 3-bromo-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3807-5864
3-bromo-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylbenzamide

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

3807-5864

Molecular Formula

C23H21BrN2O (C23 H21 BrN2 O)

Compound Name

3-bromo-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylbenzamide

IUPAC name

3-bromo-N-(2-methyl-1234-tetrahydroquinolin-4-yl)-N-phenylbenzamide

SMILES

CC(CC1N(C(c2cccc(Br)c2)=O)c2ccccc2)Nc2c1cccc2

InChI

InChI=1S/C23H21BrN2O/c1-16-14-22(20-12-5-6-13-21(20)25-16)26(19-10-3-2-4-11-19)23(27)17-8-7-9-18(24)15-17/h2-13,15-16,22,25H,14H2,1H3

InChI Key

FCOANDILHCHPAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01564051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.536

Distribution Coefficient, logD

5.536

Water Solubility, LogSw

-5.45

Polar Surface Area

25.624

Acid Dissociation Constant (pKa)

21.08

Base Dissociation Constant (pKb)

3.65

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

17.40

3807-5864 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3807-5864 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3807-5864?
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What is the minimum amount of 3807-5864 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3807-5864
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3807-5864
  • 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 3807-5864 available by request