P123-0299 Screening compound: (2E)-3-(furan-2-yl)-N-{1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}prop-2-enamide

P123-0299 Screening compound: (2E)-3-(furan-2-yl)-N-{1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}prop-2-enamide
P123-0299 Screening compound: (2E)-3-(furan-2-yl)-N-{1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P123-0299
(2E)-3-(furan-2-yl)-N-{1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}prop-2-enamide

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

P123-0299

Molecular Formula

C19H22N4O3 (C19 H22 N4 O3)

Compound Name

(2E)-3-(furan-2-yl)-N-{1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}prop-2-enamide

IUPAC name

(2E)-3-(furan-2-yl)-N-{1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}prop-2-enamide

SMILES

CC(C(N(CC1)CCN1c1ncccc1)=O)NC(/C=C/c1ccco1)=O

InChI

InChI=1S/C19H22N4O3/c1-15(21-18(24)8-7-16-5-4-14-26-16)19(25)23-12-10-22(11-13-23)17-6-2-3-9-20-17/h2-9,14-15H,10-13H2,1H3,(H,21,24)/t15-/m0/s1

InChI Key

AMSBBKJSDFDWFJ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27565772

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.764

Distribution Coefficient, logD

1.755

Water Solubility, LogSw

-1.90

Polar Surface Area

60.042

Acid Dissociation Constant (pKa)

13.20

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.58

P123-0299 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P123-0299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P123-0299?
Check Price and Availability of P123-0299, 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 P123-0299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P123-0299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P123-0299
  • 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 P123-0299 available by request