V031-0350 Screening compound: N-benzyl-N-methyl{5-[3-(trifluoromethyl)phenyl]-3-pyridyl}methanamine

V031-0350 Screening compound: N-benzyl-N-methyl{5-[3-(trifluoromethyl)phenyl]-3-pyridyl}methanamine
V031-0350 Screening compound: N-benzyl-N-methyl{5-[3-(trifluoromethyl)phenyl]-3-pyridyl}methanamine alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-0350
N-benzyl-N-methyl{5-[3-(trifluoromethyl)phenyl]-3-pyridyl}methanamine

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

V031-0350

Molecular Formula

C21H19F3N2 (C21 H19 F3 N2)

Compound Name

N-benzyl-N-methyl{5-[3-(trifluoromethyl)phenyl]-3-pyridyl}methanamine

IUPAC name

benzyl(methyl)({5-[3-(trifluoromethyl)phenyl]pyridin-3-yl}methyl)amine

SMILES

CN(Cc1ccccc1)Cc1cc(-c2cccc(C(F)(F)F)c2)cnc1

InChI

InChI=1S/C21H19F3N2/c1-26(14-16-6-3-2-4-7-16)15-17-10-19(13-25-12-17)18-8-5-9-20(11-18)21(22,23)24/h2-13H,14-15H2,1H3

InChI Key

KDEWNARIZUXXRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19901527

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

356.39

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.821

Distribution Coefficient, logD

4.716

Water Solubility, LogSw

-4.58

Polar Surface Area

13.419

Acid Dissociation Constant (pKa)

24.79

Base Dissociation Constant (pKb)

6.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

V031-0350 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with V031-0350 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-0350?
Check Price and Availability of V031-0350, 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 V031-0350 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-0350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-0350
  • 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 V031-0350 available by request