P612-0469 Screening compound: 2-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}-1,3-thiazol-4-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one

P612-0469 Screening compound: 2-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}-1,3-thiazol-4-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one
P612-0469 Screening compound: 2-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}-1,3-thiazol-4-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P612-0469
2-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}-1,3-thiazol-4-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one

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

P612-0469

Molecular Formula

C24H24FN5OS (C24 H24 FN5 OS)

Compound Name

2-(2-{1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl}-1,3-thiazol-4-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one

IUPAC name

2-(2-{1-ethyl-1H-pyrrolo[23-b]pyridin-3-yl}-13-thiazol-4-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one

SMILES

CCn1c(nccc2)c2c(-c2nc(CC(N(CC3)CCN3c(cc3)ccc3F)=O)cs2)c1

InChI

InChI=1S/C24H24FN5OS/c1-2-28-15-21(20-4-3-9-26-23(20)28)24-27-18(16-32-24)14-22(31)30-12-10-29(11-13-30)19-7-5-17(25)6-8-19/h3-9,15-16H,2,10-14H2,1H3

InChI Key

WLMSKSGLFAKSPO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27606561

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.805

Distribution Coefficient, logD

3.801

Water Solubility, LogSw

-3.75

Polar Surface Area

41.484

Acid Dissociation Constant (pKa)

21.38

Base Dissociation Constant (pKb)

5.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

P612-0469 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Hsp90-Targeted Library (11355 compounds)

MCL1 Targeted Library (12200 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P612-0469 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P612-0469?
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What is the minimum amount of P612-0469 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P612-0469
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P612-0469
  • 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 P612-0469 available by request