F415-0416 Screening compound: 4-({[2-(3-chloro-4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4-yl]sulfanyl}methyl)-5-methyl-2-phenyl-1,3-oxazole

F415-0416 Screening compound: 4-({[2-(3-chloro-4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4-yl]sulfanyl}methyl)-5-methyl-2-phenyl-1,3-oxazole
F415-0416 Screening compound: 4-({[2-(3-chloro-4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4-yl]sulfanyl}methyl)-5-methyl-2-phenyl-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound F415-0416
4-({[2-(3-chloro-4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4-yl]sulfanyl}methyl)-5-methyl-2-phenyl-1,3-oxazole

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

F415-0416

Molecular Formula

C25H21ClN4O2S (C25 H21 ClN4 O2 S)

Compound Name

4-({[2-(3-chloro-4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4-yl]sulfanyl}methyl)-5-methyl-2-phenyl-1,3-oxazole

IUPAC name

4-({[2-(3-chloro-4-ethoxyphenyl)pyrazolo[15-a]pyrazin-4-yl]sulfanyl}methyl)-5-methyl-2-phenyl-13-oxazole

SMILES

CCOc(ccc(-c1nn(ccnc2SCc3c(C)oc(-c4ccccc4)n3)c2c1)c1)c1Cl

InChI

InChI=1S/C25H21ClN4O2S/c1-3-31-23-10-9-18(13-19(23)26)20-14-22-25(27-11-12-30(22)29-20)33-15-21-16(2)32-24(28-21)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3

InChI Key

GCFJDVOMEDKXCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18201898

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.99

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.489

Distribution Coefficient, logD

5.489

Water Solubility, LogSw

-5.99

Polar Surface Area

45.081

Acid Dissociation Constant (pKa)

27.41

Base Dissociation Constant (pKb)

3.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

F415-0416 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F415-0416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F415-0416?
Check Price and Availability of F415-0416, 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 F415-0416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F415-0416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F415-0416
  • 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 F415-0416 available by request