M509-0434 Screening compound: 1-(4-bromo-3-methylphenyl)-3-(2-{1-propyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)urea

M509-0434 Screening compound: 1-(4-bromo-3-methylphenyl)-3-(2-{1-propyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)urea
M509-0434 Screening compound: 1-(4-bromo-3-methylphenyl)-3-(2-{1-propyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound M509-0434
1-(4-bromo-3-methylphenyl)-3-(2-{1-propyl-1H-pyrrolo[2,3-b]pyridin-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

M509-0434

Molecular Formula

C20H23BrN4O (C20 H23 BrN4 O)

Compound Name

1-(4-bromo-3-methylphenyl)-3-(2-{1-propyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)urea

IUPAC name

1-(4-bromo-3-methylphenyl)-3-(2-{1-propyl-1H-pyrrolo[23-b]pyridin-3-yl}ethyl)urea

SMILES

CCCn1c(nccc2)c2c(CCNC(Nc(cc2)cc(C)c2Br)=O)c1

InChI

InChI=1S/C20H23BrN4O/c1-3-11-25-13-15(17-5-4-9-22-19(17)25)8-10-23-20(26)24-16-6-7-18(21)14(2)12-16/h4-7,9,12-13H,3,8,10-11H2,1-2H3,(H2,23,24,26)

InChI Key

WZSVBOAQSVPJOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27545300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.33

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

4.441

Distribution Coefficient, logD

4.436

Water Solubility, LogSw

-4.09

Polar Surface Area

45.594

Acid Dissociation Constant (pKa)

11.74

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

M509-0434 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Hsp90-Targeted Library (11355 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with M509-0434 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M509-0434?
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What is the minimum amount of M509-0434 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M509-0434
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M509-0434
  • 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 M509-0434 available by request