V019-2645 Screening compound: benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine

V019-2645 Screening compound: benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine
V019-2645 Screening compound: benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-2645
benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine

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

V019-2645

Molecular Formula

C20H21F2NO2 (C20 H21 F2 NO2)

Compound Name

benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine

IUPAC name

benzyl[(24-difluorophenyl)methyl][2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine

SMILES

C#CCOCC(CN(Cc1ccccc1)Cc(ccc(F)c1)c1F)O

InChI

InChI=1S/C20H21F2NO2/c1-2-10-25-15-19(24)14-23(12-16-6-4-3-5-7-16)13-17-8-9-18(21)11-20(17)22/h1,3-9,11,19,24H,10,12-15H2/t19-/m0/s1

InChI Key

SQUYCPYNELLDKI-IBGZPJMESA-N

MDL Number (MFCD)

MFCD10453979

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

345.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.398

Distribution Coefficient, logD

3.394

Water Solubility, LogSw

-3.49

Polar Surface Area

28.923

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

5.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

V019-2645 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with V019-2645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-2645?
Check Price and Availability of V019-2645, 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 V019-2645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-2645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-2645
  • 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 V019-2645 available by request