E567-0302 Screening compound: 3-[(1,2-benzoxazol-3-yl)methyl]-1-[2-(2,5-dimethoxyphenyl)ethyl]urea

E567-0302 Screening compound: 3-[(1,2-benzoxazol-3-yl)methyl]-1-[2-(2,5-dimethoxyphenyl)ethyl]urea
E567-0302 Screening compound: 3-[(1,2-benzoxazol-3-yl)methyl]-1-[2-(2,5-dimethoxyphenyl)ethyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E567-0302
3-[(1,2-benzoxazol-3-yl)methyl]-1-[2-(2,5-dimethoxyphenyl)ethyl]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

E567-0302

Molecular Formula

C19H21N3O4 (C19 H21 N3 O4)

Compound Name

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

IUPAC name

3-[(12-benzoxazol-3-yl)methyl]-1-[2-(25-dimethoxyphenyl)ethyl]urea

SMILES

COc(cc1)cc(CCNC(NCc2noc3c2cccc3)=O)c1OC

InChI

InChI=1S/C19H21N3O4/c1-24-14-7-8-17(25-2)13(11-14)9-10-20-19(23)21-12-16-15-5-3-4-6-18(15)26-22-16/h3-8,11H,9-10,12H2,1-2H3,(H2,20,21,23)

InChI Key

OILWXNGRXDZHEK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.967

Distribution Coefficient, logD

2.967

Water Solubility, LogSw

-3.40

Polar Surface Area

72.896

Acid Dissociation Constant (pKa)

13.59

Base Dissociation Constant (pKb)

2.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

E567-0302 in Drug Discovery

Included in Screening Libraries

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 E567-0302 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E567-0302?
Check Price and Availability of E567-0302, 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 E567-0302 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E567-0302
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E567-0302
  • 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 E567-0302 available by request