L662-0655 Screening compound: 4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

L662-0655 Screening compound: 4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
L662-0655 Screening compound: 4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L662-0655
4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

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

L662-0655

Molecular Formula

C27H22FN3O2 (C27 H22 FN3 O2)

Compound Name

4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

IUPAC name

4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}-N-(1234-tetrahydronaphthalen-1-yl)benzamide

SMILES

O=C(c(cc1)ccc1Oc1ccnc(-c(cc2)ccc2F)n1)NC(CCC1)c2c1cccc2

InChI

InChI=1S/C27H22FN3O2/c28-21-12-8-19(9-13-21)26-29-17-16-25(31-26)33-22-14-10-20(11-15-22)27(32)30-24-7-3-5-18-4-1-2-6-23(18)24/h1-2,4,6,8-17,24H,3,5,7H2,(H,30,32)/t24-/m0/s1

InChI Key

XIJFHMXCIJNQJO-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD27467747

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.293

Distribution Coefficient, logD

5.293

Water Solubility, LogSw

-5.61

Polar Surface Area

49.875

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

2.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.80

L662-0655 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Targeted Diversity Library (40567 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with L662-0655 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L662-0655?
Check Price and Availability of L662-0655, 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 L662-0655 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L662-0655
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L662-0655
  • 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 L662-0655 available by request