V030-6841 Screening compound: benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(2-methylpropoxy)propyl]amine

V030-6841 Screening compound: benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(2-methylpropoxy)propyl]amine
V030-6841 Screening compound: benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(2-methylpropoxy)propyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-6841
benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(2-methylpropoxy)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

V030-6841

Molecular Formula

C21H27F2NO2 (C21 H27 F2 NO2)

Compound Name

benzyl[(2,4-difluorophenyl)methyl][2-hydroxy-3-(2-methylpropoxy)propyl]amine

IUPAC name

benzyl[(24-difluorophenyl)methyl][2-hydroxy-3-(2-methylpropoxy)propyl]amine

SMILES

CC(C)COCC(CN(Cc1ccccc1)Cc(ccc(F)c1)c1F)O

InChI

InChI=1S/C21H27F2NO2/c1-16(2)14-26-15-20(25)13-24(11-17-6-4-3-5-7-17)12-18-8-9-19(22)10-21(18)23/h3-10,16,20,25H,11-15H2,1-2H3/t20-/m0/s1

InChI Key

GUHMXSQSIQSFCC-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19841083

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

363.45

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

4.344

Distribution Coefficient, logD

4.331

Water Solubility, LogSw

-4.26

Polar Surface Area

29.004

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

5.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

V030-6841 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V030-6841 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-6841?
Check Price and Availability of V030-6841, 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 V030-6841 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-6841
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-6841
  • 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 V030-6841 available by request