M513-1238 Screening compound: 1-(5-bromofuran-2-carbonyl)-4-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)piperazine

M513-1238 Screening compound: 1-(5-bromofuran-2-carbonyl)-4-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)piperazine
M513-1238 Screening compound: 1-(5-bromofuran-2-carbonyl)-4-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M513-1238
1-(5-bromofuran-2-carbonyl)-4-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)piperazine

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

M513-1238

Molecular Formula

C20H23BrN4O2 (C20 H23 BrN4 O2)

Compound Name

1-(5-bromofuran-2-carbonyl)-4-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}ethyl)piperazine

IUPAC name

1-(5-bromofuran-2-carbonyl)-4-(2-{1-ethyl-1H-pyrrolo[23-b]pyridin-3-yl}ethyl)piperazine

SMILES

CCn1c(nccc2)c2c(CCN(CC2)CCN2C(c(o2)ccc2Br)=O)c1

InChI

InChI=1S/C20H23BrN4O2/c1-2-24-14-15(16-4-3-8-22-19(16)24)7-9-23-10-12-25(13-11-23)20(26)17-5-6-18(21)27-17/h3-6,8,14H,2,7,9-13H2,1H3

InChI Key

DPWQZQXMFVVGNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27546036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.385

Distribution Coefficient, logD

2.296

Water Solubility, LogSw

-2.31

Polar Surface Area

40.967

Acid Dissociation Constant (pKa)

25.09

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

M513-1238 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Hsp90-Targeted Library (11355 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M513-1238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M513-1238?
Check Price and Availability of M513-1238, 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 M513-1238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M513-1238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M513-1238
  • 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 M513-1238 available by request