Y500-5064 Screening compound: N-(3-fluorophenethyl)-N-(2,4,5-trimethoxybenzyl)amine

Y500-5064 Screening compound: N-(3-fluorophenethyl)-N-(2,4,5-trimethoxybenzyl)amine
Y500-5064 Screening compound: N-(3-fluorophenethyl)-N-(2,4,5-trimethoxybenzyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y500-5064
N-(3-fluorophenethyl)-N-(2,4,5-trimethoxybenzyl)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

Y500-5064

Molecular Formula

C18H22FNO3 (C18 H22 FNO3)

Compound Name

N-(3-fluorophenethyl)-N-(2,4,5-trimethoxybenzyl)amine

IUPAC name

[2-(3-fluorophenyl)ethyl][(245-trimethoxyphenyl)methyl]amine

SMILES

COc(cc1OC)c(CNCCc2cccc(F)c2)cc1OC

InChI

InChI=1S/C18H22FNO3/c1-21-16-11-18(23-3)17(22-2)10-14(16)12-20-8-7-13-5-4-6-15(19)9-13/h4-6,9-11,20H,7-8,12H2,1-3H3

InChI Key

RTPHPPXPQPBABA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.567

Distribution Coefficient, logD

0.107

Water Solubility, LogSw

-2.65

Polar Surface Area

34.737

Acid Dissociation Constant (pKa)

25.76

Base Dissociation Constant (pKb)

9.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

Y500-5064 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y500-5064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y500-5064?
Check Price and Availability of Y500-5064, 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 Y500-5064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y500-5064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y500-5064
  • 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 Y500-5064 available by request