P131-0439 Screening compound: N-[(4-ethylphenyl)methyl]-3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]benzamide

P131-0439 Screening compound: N-[(4-ethylphenyl)methyl]-3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]benzamide
P131-0439 Screening compound: N-[(4-ethylphenyl)methyl]-3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P131-0439
N-[(4-ethylphenyl)methyl]-3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]benzamide

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

P131-0439

Molecular Formula

C24H26N4O (C24 H26 N4 O)

Compound Name

N-[(4-ethylphenyl)methyl]-3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]benzamide

IUPAC name

N-[(4-ethylphenyl)methyl]-3-[3-(pyrrolidin-1-yl)pyrazin-2-yl]benzamide

SMILES

CCc1ccc(CNC(c2cc(-c3nccnc3N3CCCC3)ccc2)=O)cc1

InChI

InChI=1S/C24H26N4O/c1-2-18-8-10-19(11-9-18)17-27-24(29)21-7-5-6-20(16-21)22-23(26-13-12-25-22)28-14-3-4-15-28/h5-13,16H,2-4,14-15,17H2,1H3,(H,27,29)

InChI Key

IHRNEZJIMCCTMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27566217

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.432

Distribution Coefficient, logD

4.432

Water Solubility, LogSw

-4.23

Polar Surface Area

46.998

Acid Dissociation Constant (pKa)

12.10

Base Dissociation Constant (pKb)

2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

P131-0439 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P131-0439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P131-0439?
Check Price and Availability of P131-0439, 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 P131-0439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P131-0439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P131-0439
  • 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 P131-0439 available by request