E569-0010 Screening compound: 3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-1-(pyridin-2-yl)urea

E569-0010 Screening compound: 3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-1-(pyridin-2-yl)urea
E569-0010 Screening compound: 3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-1-(pyridin-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E569-0010
3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-1-(pyridin-2-yl)urea

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

E569-0010

Molecular Formula

C15H14N4O2 (C15 H14 N4 O2)

Compound Name

3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-1-(pyridin-2-yl)urea

IUPAC name

3-[(5-methyl-12-benzoxazol-3-yl)methyl]-1-(pyridin-2-yl)urea

SMILES

Cc(cc1)cc2c1onc2CNC(Nc1ncccc1)=O

InChI

InChI=1S/C15H14N4O2/c1-10-5-6-13-11(8-10)12(19-21-13)9-17-15(20)18-14-4-2-3-7-16-14/h2-8H,9H2,1H3,(H2,16,17,18,20)

InChI Key

GNSSGEHCJYIETE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.810

Distribution Coefficient, logD

2.803

Water Solubility, LogSw

-3.17

Polar Surface Area

66.173

Acid Dissociation Constant (pKa)

12.00

Base Dissociation Constant (pKb)

5.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.33

E569-0010 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Fragments Library (11262 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Proteases
  • Kinases
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with E569-0010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E569-0010?
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What is the minimum amount of E569-0010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E569-0010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E569-0010
  • 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 E569-0010 available by request