0167-0239 Screening compound: [1-(1H-indol-3-yl)propan-2-yl]urea

0167-0239 Screening compound: [1-(1H-indol-3-yl)propan-2-yl]urea
0167-0239 Screening compound: [1-(1H-indol-3-yl)propan-2-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 0167-0239
[1-(1H-indol-3-yl)propan-2-yl]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

0167-0239

Molecular Formula

C12H15N3O (C12 H15 N3 O)

Compound Name

[1-(1H-indol-3-yl)propan-2-yl]urea

IUPAC name

[1-(1H-indol-3-yl)propan-2-yl]urea

SMILES

CC(Cc1c[nH]c2c1cccc2)NC(N)=O

InChI

InChI=1S/C12H15N3O/c1-8(15-12(13)16)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7-8,14H,6H2,1H3,(H3,13,15,16)/t8-/m0/s1

InChI Key

PSFMVOVXJJUGPM-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD00458396

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

217.27

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.785

Distribution Coefficient, logD

1.785

Water Solubility, LogSw

-2.23

Polar Surface Area

54.933

Acid Dissociation Constant (pKa)

15.62

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

0167-0239 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0167-0239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0167-0239?
Check Price and Availability of 0167-0239, 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 0167-0239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0167-0239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0167-0239
  • 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 0167-0239 available by request