3616-2100 Screening compound: 5-(4-fluorophenyl)-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)furan-2-carboxamide

3616-2100 Screening compound: 5-(4-fluorophenyl)-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)furan-2-carboxamide
3616-2100 Screening compound: 5-(4-fluorophenyl)-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3616-2100
5-(4-fluorophenyl)-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)furan-2-carboxamide

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

3616-2100

Molecular Formula

C24H16FN3O3 (C24 H16 FN3 O3)

Compound Name

5-(4-fluorophenyl)-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)furan-2-carboxamide

IUPAC name

5-(4-fluorophenyl)-N-(2-methyl-3-{[13]oxazolo[45-b]pyridin-2-yl}phenyl)furan-2-carboxamide

SMILES

Cc(c(-c1nc(nccc2)c2o1)ccc1)c1NC(c1ccc(-c(cc2)ccc2F)o1)=O

InChI

InChI=1S/C24H16FN3O3/c1-14-17(24-28-22-20(31-24)6-3-13-26-22)4-2-5-18(14)27-23(29)21-12-11-19(30-21)15-7-9-16(25)10-8-15/h2-13H,1H3,(H,27,29)

InChI Key

XQZKZORTHFYRBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05819626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.215

Distribution Coefficient, logD

5.215

Water Solubility, LogSw

-4.97

Polar Surface Area

58.215

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

2.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

3616-2100 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3616-2100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3616-2100?
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What is the minimum amount of 3616-2100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3616-2100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3616-2100
  • 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 3616-2100 available by request