M509-0485 Screening compound: 3-{2-[1-(2-methylpropyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl}-1-phenylurea

M509-0485 Screening compound: 3-{2-[1-(2-methylpropyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl}-1-phenylurea
M509-0485 Screening compound: 3-{2-[1-(2-methylpropyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl}-1-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound M509-0485
3-{2-[1-(2-methylpropyl)-1H-pyrrolo[2,3-b]pyridin-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

M509-0485

Molecular Formula

C20H24N4O (C20 H24 N4 O)

Compound Name

3-{2-[1-(2-methylpropyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl}-1-phenylurea

IUPAC name

3-{2-[1-(2-methylpropyl)-1H-pyrrolo[23-b]pyridin-3-yl]ethyl}-1-phenylurea

SMILES

CC(C)Cn1c(nccc2)c2c(CCNC(Nc2ccccc2)=O)c1

InChI

InChI=1S/C20H24N4O/c1-15(2)13-24-14-16(18-9-6-11-21-19(18)24)10-12-22-20(25)23-17-7-4-3-5-8-17/h3-9,11,14-15H,10,12-13H2,1-2H3,(H2,22,23,25)

InChI Key

MWLZICHGEKXNKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27545318

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.44

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.527

Distribution Coefficient, logD

3.524

Water Solubility, LogSw

-3.53

Polar Surface Area

45.615

Acid Dissociation Constant (pKa)

13.35

Base Dissociation Constant (pKb)

5.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

M509-0485 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Hsp90-Targeted Library (11355 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with M509-0485 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M509-0485?
Check Price and Availability of M509-0485, 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 M509-0485 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M509-0485
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M509-0485
  • 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 M509-0485 available by request