J010-0016 Screening compound: N-[5-(1,3-benzoxazol-2-yl)pyridin-3-yl]-3-chlorobenzamide

J010-0016 Screening compound: N-[5-(1,3-benzoxazol-2-yl)pyridin-3-yl]-3-chlorobenzamide
J010-0016 Screening compound: N-[5-(1,3-benzoxazol-2-yl)pyridin-3-yl]-3-chlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J010-0016
N-[5-(1,3-benzoxazol-2-yl)pyridin-3-yl]-3-chlorobenzamide

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

J010-0016

Molecular Formula

C19H12ClN3O2 (C19 H12 ClN3 O2)

Compound Name

N-[5-(1,3-benzoxazol-2-yl)pyridin-3-yl]-3-chlorobenzamide

IUPAC name

N-[5-(13-benzoxazol-2-yl)pyridin-3-yl]-3-chlorobenzamide

SMILES

O=C(c1cccc(Cl)c1)Nc1cncc(-c2nc(cccc3)c3o2)c1

InChI

InChI=1S/C19H12ClN3O2/c20-14-5-3-4-12(8-14)18(24)22-15-9-13(10-21-11-15)19-23-16-6-1-2-7-17(16)25-19/h1-11H,(H,22,24)

InChI Key

XLKTXHXOHRIXPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27216615

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.78

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.622

Distribution Coefficient, logD

4.622

Water Solubility, LogSw

-4.78

Polar Surface Area

49.747

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

3.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

J010-0016 in Drug Discovery

Included in Screening Libraries

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

C-Met Library (15277 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with J010-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J010-0016?
Check Price and Availability of J010-0016, 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 J010-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J010-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J010-0016
  • 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 J010-0016 available by request