D047-0126 Screening compound: N-(4-ACETYLPHENYL)-N'-[2-(1H-INDOL-3-YL)ETHYL]UREA

D047-0126 Screening compound: N-(4-ACETYLPHENYL)-N'-[2-(1H-INDOL-3-YL)ETHYL]UREA
D047-0126 Screening compound: N-(4-ACETYLPHENYL)-N'-[2-(1H-INDOL-3-YL)ETHYL]UREA alternative view

Chemical Structure Depiction of ChemDiv screening compound D047-0126
N-(4-ACETYLPHENYL)-N'-[2-(1H-INDOL-3-YL)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

D047-0126

Molecular Formula

C19H19N3O2 (C19 H19 N3 O2)

Compound Name

N-(4-ACETYLPHENYL)-N'-[2-(1H-INDOL-3-YL)ETHYL]UREA

IUPAC name

n/a

SMILES

CC(c(cc1)ccc1NC(NCCc1c[nH]c2c1cccc2)=O)=O

InChI

InChI=1S/C19H19N3O2/c1-13(23)14-6-8-16(9-7-14)22-19(24)20-11-10-15-12-21-18-5-3-2-4-17(15)18/h2-9,12,21H,10-11H2,1H3,(H2,20,22,24)

InChI Key

YCPWSHMQXFPQSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04006200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.957

Distribution Coefficient, logD

2.957

Water Solubility, LogSw

-3.28

Polar Surface Area

57.403

Acid Dissociation Constant (pKa)

11.26

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.00

D047-0126 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

STING Agonist Library (5895 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Immune system
  • Cancer
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with D047-0126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D047-0126?
Check Price and Availability of D047-0126, 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 D047-0126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D047-0126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D047-0126
  • 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 D047-0126 available by request