D048-0076 Screening compound: 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)urea

D048-0076 Screening compound: 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)urea
D048-0076 Screening compound: 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D048-0076
3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)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

D048-0076

Molecular Formula

C18H22N2O4 (C18 H22 N2 O4)

Compound Name

3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)urea

IUPAC name

3-[2-(34-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)urea

SMILES

COc(cc1)ccc1NC(NCCc(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C18H22N2O4/c1-22-15-7-5-14(6-8-15)20-18(21)19-11-10-13-4-9-16(23-2)17(12-13)24-3/h4-9,12H,10-11H2,1-3H3,(H2,19,20,21)

InChI Key

VLXJIIUVTTXSAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01259837

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.38

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

2.563

Distribution Coefficient, logD

2.563

Water Solubility, LogSw

-3.06

Polar Surface Area

56.510

Acid Dissociation Constant (pKa)

13.03

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

D048-0076 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D048-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D048-0076?
Check Price and Availability of D048-0076, 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 D048-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D048-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D048-0076
  • 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 D048-0076 available by request