L716-1013 Screening compound: N-(3-fluorophenyl)-4-{[3-(phenylsulfanyl)pyrazin-2-yl]oxy}benzamide

L716-1013 Screening compound: N-(3-fluorophenyl)-4-{[3-(phenylsulfanyl)pyrazin-2-yl]oxy}benzamide
L716-1013 Screening compound: N-(3-fluorophenyl)-4-{[3-(phenylsulfanyl)pyrazin-2-yl]oxy}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L716-1013
N-(3-fluorophenyl)-4-{[3-(phenylsulfanyl)pyrazin-2-yl]oxy}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

L716-1013

Molecular Formula

C23H16FN3O2S (C23 H16 FN3 O2 S)

Compound Name

N-(3-fluorophenyl)-4-{[3-(phenylsulfanyl)pyrazin-2-yl]oxy}benzamide

IUPAC name

N-(3-fluorophenyl)-4-{[3-(phenylsulfanyl)pyrazin-2-yl]oxy}benzamide

SMILES

O=C(c(cc1)ccc1Oc1nccnc1Sc1ccccc1)Nc1cc(F)ccc1

InChI

InChI=1S/C23H16FN3O2S/c24-17-5-4-6-18(15-17)27-21(28)16-9-11-19(12-10-16)29-22-23(26-14-13-25-22)30-20-7-2-1-3-8-20/h1-15H,(H,27,28)

InChI Key

KEKIXIZFSCODEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15133853

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.430

Distribution Coefficient, logD

5.428

Water Solubility, LogSw

-5.87

Polar Surface Area

48.790

Acid Dissociation Constant (pKa)

9.64

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

L716-1013 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L716-1013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L716-1013?
Check Price and Availability of L716-1013, 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 L716-1013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L716-1013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L716-1013
  • 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 L716-1013 available by request