D725-0014 Screening compound: 4-ethyl-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide

D725-0014 Screening compound: 4-ethyl-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide
D725-0014 Screening compound: 4-ethyl-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D725-0014
4-ethyl-N-(2-methyl-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)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

D725-0014

Molecular Formula

C22H19N3O2 (C22 H19 N3 O2)

Compound Name

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

IUPAC name

4-ethyl-N-(2-methyl-3-{[13]oxazolo[45-b]pyridin-2-yl}phenyl)benzamide

SMILES

CCc(cc1)ccc1C(Nc1c(C)c(-c2nc(nccc3)c3o2)ccc1)=O

InChI

InChI=1S/C22H19N3O2/c1-3-15-9-11-16(12-10-15)21(26)24-18-7-4-6-17(14(18)2)22-25-20-19(27-22)8-5-13-23-20/h4-13H,3H2,1-2H3,(H,24,26)

InChI Key

NCLRJFMKXVSEAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07362613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.822

Distribution Coefficient, logD

4.822

Water Solubility, LogSw

-4.39

Polar Surface Area

49.816

Acid Dissociation Constant (pKa)

11.53

Base Dissociation Constant (pKb)

2.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

D725-0014 in Drug Discovery

Included in Screening Libraries

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

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D725-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D725-0014?
Check Price and Availability of D725-0014, 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 D725-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D725-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D725-0014
  • 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 D725-0014 available by request