6408-0740 Screening compound: 2-(4-{[(adamantan-1-yl)amino]methyl}-2-bromo-6-ethoxyphenoxy)-N-tert-butylacetamide

6408-0740 Screening compound: 2-(4-{[(adamantan-1-yl)amino]methyl}-2-bromo-6-ethoxyphenoxy)-N-tert-butylacetamide
6408-0740 Screening compound: 2-(4-{[(adamantan-1-yl)amino]methyl}-2-bromo-6-ethoxyphenoxy)-N-tert-butylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6408-0740
2-(4-{[(adamantan-1-yl)amino]methyl}-2-bromo-6-ethoxyphenoxy)-N-tert-butylacetamide

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

6408-0740

Molecular Formula

C25H37BrN2O3 (C25 H37 BrN2 O3)

Compound Name

2-(4-{[(adamantan-1-yl)amino]methyl}-2-bromo-6-ethoxyphenoxy)-N-tert-butylacetamide

IUPAC name

2-(4-{[(adamantan-1-yl)amino]methyl}-2-bromo-6-ethoxyphenoxy)-N-tert-butylacetamide

SMILES

CCOc1cc(CNC2(CC(C3)C4)CC4CC3C2)cc(Br)c1OCC(NC(C)(C)C)=O

InChI

InChI=1S/C25H37BrN2O3/c1-5-30-21-10-19(9-20(26)23(21)31-15-22(29)28-24(2,3)4)14-27-25-11-16-6-17(12-25)8-18(7-16)13-25/h9-10,16-18,27H,5-8,11-15H2,1-4H3,(H,28,29)

InChI Key

QTBBQGIDOXRZAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04090265

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

493.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.456

Distribution Coefficient, logD

2.494

Water Solubility, LogSw

-5.38

Polar Surface Area

49.669

Acid Dissociation Constant (pKa)

15.22

Base Dissociation Constant (pKb)

10.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.00

6408-0740 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6408-0740 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6408-0740?
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What is the minimum amount of 6408-0740 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6408-0740
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6408-0740
  • 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 6408-0740 available by request