V006-0819 Screening compound: 1-{[(2,5-dimethylphenyl)methyl](propan-2-yl)amino}-3-(2-methylphenoxy)propan-2-ol

V006-0819 Screening compound: 1-{[(2,5-dimethylphenyl)methyl](propan-2-yl)amino}-3-(2-methylphenoxy)propan-2-ol
V006-0819 Screening compound: 1-{[(2,5-dimethylphenyl)methyl](propan-2-yl)amino}-3-(2-methylphenoxy)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-0819
1-{[(2,5-dimethylphenyl)methyl](propan-2-yl)amino}-3-(2-methylphenoxy)propan-2-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

V006-0819

Molecular Formula

C22H31NO2 (C22 H31 NO2)

Compound Name

1-{[(2,5-dimethylphenyl)methyl](propan-2-yl)amino}-3-(2-methylphenoxy)propan-2-ol

IUPAC name

1-{[(25-dimethylphenyl)methyl](propan-2-yl)amino}-3-(2-methylphenoxy)propan-2-ol

SMILES

CC(C)N(CC(COc1c(C)cccc1)O)Cc1c(C)ccc(C)c1

InChI

InChI=1S/C22H31NO2/c1-16(2)23(13-20-12-17(3)10-11-18(20)4)14-21(24)15-25-22-9-7-6-8-19(22)5/h6-12,16,21,24H,13-15H2,1-5H3/t21-/m0/s1

InChI Key

VPVOOIGJPNHMMI-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14262848

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

341.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.607

Distribution Coefficient, logD

4.747

Water Solubility, LogSw

-5.47

Polar Surface Area

27.791

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

8.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

V006-0819 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with V006-0819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-0819?
Check Price and Availability of V006-0819, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V006-0819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-0819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-0819
  • 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 V006-0819 available by request