S055-0873 Screening compound: 3-[(2-ethoxypyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]urea

S055-0873 Screening compound: 3-[(2-ethoxypyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]urea
S055-0873 Screening compound: 3-[(2-ethoxypyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound S055-0873
3-[(2-ethoxypyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]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

S055-0873

Molecular Formula

C17H21N3O3 (C17 H21 N3 O3)

Compound Name

3-[(2-ethoxypyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]urea

IUPAC name

3-[(2-ethoxypyridin-3-yl)methyl]-1-[(3-methoxyphenyl)methyl]urea

SMILES

CCOc1c(CNC(NCc2cc(OC)ccc2)=O)cccn1

InChI

InChI=1S/C17H21N3O3/c1-3-23-16-14(7-5-9-18-16)12-20-17(21)19-11-13-6-4-8-15(10-13)22-2/h4-10H,3,11-12H2,1-2H3,(H2,19,20,21)

InChI Key

NUEUWSHBCZGETI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030742

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.446

Distribution Coefficient, logD

2.446

Water Solubility, LogSw

-2.66

Polar Surface Area

59.658

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

S055-0873 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

SmartTM Library (51161 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with S055-0873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S055-0873?
Check Price and Availability of S055-0873, 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 S055-0873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S055-0873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S055-0873
  • 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 S055-0873 available by request