6408-0421 Screening compound: 2-({[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methyl}amino)-2-methylpropan-1-ol

6408-0421 Screening compound: 2-({[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methyl}amino)-2-methylpropan-1-ol
6408-0421 Screening compound: 2-({[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methyl}amino)-2-methylpropan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6408-0421
2-({[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methyl}amino)-2-methylpropan-1-ol

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

6408-0421

Molecular Formula

C19H24BrNO3 (C19 H24 BrNO3)

Compound Name

2-({[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methyl}amino)-2-methylpropan-1-ol

IUPAC name

2-({[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methyl}amino)-2-methylpropan-1-ol

SMILES

CC(C)(CO)NCc(cc1OC)cc(Br)c1OCc1ccccc1

InChI

InChI=1S/C19H24BrNO3/c1-19(2,13-22)21-11-15-9-16(20)18(17(10-15)23-3)24-12-14-7-5-4-6-8-14/h4-10,21-22H,11-13H2,1-3H3

InChI Key

VEOMKJJXHVVBMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04090256

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

394.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.778

Distribution Coefficient, logD

0.692

Water Solubility, LogSw

-4.04

Polar Surface Area

43.504

Acid Dissociation Constant (pKa)

16.08

Base Dissociation Constant (pKb)

10.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

6408-0421 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 6408-0421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6408-0421?
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What is the minimum amount of 6408-0421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6408-0421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6408-0421
  • 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 6408-0421 available by request