D718-0094 Screening compound: 3-[2-(6-methoxy-1H-indol-3-yl)ethyl]-1-phenylurea

D718-0094 Screening compound: 3-[2-(6-methoxy-1H-indol-3-yl)ethyl]-1-phenylurea
D718-0094 Screening compound: 3-[2-(6-methoxy-1H-indol-3-yl)ethyl]-1-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound D718-0094
3-[2-(6-methoxy-1H-indol-3-yl)ethyl]-1-phenylurea

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

D718-0094

Molecular Formula

C18H19N3O2 (C18 H19 N3 O2)

Compound Name

3-[2-(6-methoxy-1H-indol-3-yl)ethyl]-1-phenylurea

IUPAC name

3-[2-(6-methoxy-1H-indol-3-yl)ethyl]-1-phenylurea

SMILES

COc(cc1)cc2c1c(CCNC(Nc1ccccc1)=O)c[nH]2

InChI

InChI=1S/C18H19N3O2/c1-23-15-7-8-16-13(12-20-17(16)11-15)9-10-19-18(22)21-14-5-3-2-4-6-14/h2-8,11-12,20H,9-10H2,1H3,(H2,19,21,22)

InChI Key

MTODGCFMCKTBSP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06603627

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.430

Distribution Coefficient, logD

3.430

Water Solubility, LogSw

-3.91

Polar Surface Area

51.120

Acid Dissociation Constant (pKa)

13.35

Base Dissociation Constant (pKb)

0.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D718-0094 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Peptidomimetic Library (37031 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
  • Mimetics
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with D718-0094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D718-0094?
Check Price and Availability of D718-0094, 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 D718-0094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D718-0094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D718-0094
  • 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 D718-0094 available by request