E567-0281 Screening compound: N-(1,2-benzisoxazol-3-ylmethyl)-N'-{2-[cyclohexyl(methyl)amino]ethyl}urea

E567-0281 Screening compound: N-(1,2-benzisoxazol-3-ylmethyl)-N'-{2-[cyclohexyl(methyl)amino]ethyl}urea
E567-0281 Screening compound: N-(1,2-benzisoxazol-3-ylmethyl)-N'-{2-[cyclohexyl(methyl)amino]ethyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E567-0281
N-(1,2-benzisoxazol-3-ylmethyl)-N'-{2-[cyclohexyl(methyl)amino]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

E567-0281

Molecular Formula

C18H26N4O2 (C18 H26 N4 O2)

Compound Name

N-(1,2-benzisoxazol-3-ylmethyl)-N'-{2-[cyclohexyl(methyl)amino]ethyl}urea

IUPAC name

3-[(12-benzoxazol-3-yl)methyl]-1-{2-[cyclohexyl(methyl)amino]ethyl}urea

SMILES

CN(CCNC(NCc1noc2c1cccc2)=O)C1CCCCC1

InChI

InChI=1S/C18H26N4O2/c1-22(14-7-3-2-4-8-14)12-11-19-18(23)20-13-16-15-9-5-6-10-17(15)24-21-16/h5-6,9-10,14H,2-4,7-8,11-13H2,1H3,(H2,19,20,23)

InChI Key

LSLNRRAQBHOMGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899089

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.605

Distribution Coefficient, logD

-0.910

Water Solubility, LogSw

-2.85

Polar Surface Area

60.759

Acid Dissociation Constant (pKa)

14.06

Base Dissociation Constant (pKb)

10.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.56

E567-0281 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E567-0281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E567-0281?
Check Price and Availability of E567-0281, 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 E567-0281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E567-0281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E567-0281
  • 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 E567-0281 available by request