P132-0440 Screening compound: N-[2-(1-azepanyl)ethyl]-4-[3-(1-pyrrolidinyl)-2-pyrazinyl]benzamide

P132-0440 Screening compound: N-[2-(1-azepanyl)ethyl]-4-[3-(1-pyrrolidinyl)-2-pyrazinyl]benzamide
P132-0440 Screening compound: N-[2-(1-azepanyl)ethyl]-4-[3-(1-pyrrolidinyl)-2-pyrazinyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P132-0440
N-[2-(1-azepanyl)ethyl]-4-[3-(1-pyrrolidinyl)-2-pyrazinyl]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

P132-0440

Molecular Formula

C23H31N5O (C23 H31 N5 O)

Compound Name

N-[2-(1-azepanyl)ethyl]-4-[3-(1-pyrrolidinyl)-2-pyrazinyl]benzamide

IUPAC name

N-[2-(azepan-1-yl)ethyl]-4-[3-(pyrrolidin-1-yl)pyrazin-2-yl]benzamide

SMILES

O=C(c(cc1)ccc1-c1nccnc1N1CCCC1)NCCN1CCCCCC1

InChI

InChI=1S/C23H31N5O/c29-23(26-13-18-27-14-3-1-2-4-15-27)20-9-7-19(8-10-20)21-22(25-12-11-24-21)28-16-5-6-17-28/h7-12H,1-6,13-18H2,(H,26,29)

InChI Key

ORHPZYFKGSIDAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27566285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.029

Distribution Coefficient, logD

2.052

Water Solubility, LogSw

-3.19

Polar Surface Area

51.153

Acid Dissociation Constant (pKa)

12.57

Base Dissociation Constant (pKb)

8.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.17

P132-0440 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-Inflammatory Library (24602 compounds)

GPCR Targeted Library (31838 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P132-0440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P132-0440?
Check Price and Availability of P132-0440, 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 P132-0440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P132-0440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P132-0440
  • 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 P132-0440 available by request