P218-3426 Screening compound: 3-[2-(4-methoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepine-5-carbonyl]-1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole

P218-3426 Screening compound: 3-[2-(4-methoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepine-5-carbonyl]-1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole
P218-3426 Screening compound: 3-[2-(4-methoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepine-5-carbonyl]-1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole alternative view

Chemical Structure Depiction of ChemDiv screening compound P218-3426
3-[2-(4-methoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepine-5-carbonyl]-1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole

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

P218-3426

Molecular Formula

C25H32N4O3 (C25 H32 N4 O3)

Compound Name

3-[2-(4-methoxyphenyl)-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,4]diazepine-5-carbonyl]-1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole

IUPAC name

3-[2-(4-methoxyphenyl)-4H5H6H7H8H-pyrazolo[15-a][14]diazepine-5-carbonyl]-1-(3-methoxypropyl)-25-dimethyl-1H-pyrrole

SMILES

Cc1cc(C(N2Cc3cc(-c(cc4)ccc4OC)nn3CCC2)=O)c(C)n1CCCOC

InChI

InChI=1S/C25H32N4O3/c1-18-15-23(19(2)28(18)12-6-14-31-3)25(30)27-11-5-13-29-21(17-27)16-24(26-29)20-7-9-22(32-4)10-8-20/h7-10,15-16H,5-6,11-14,17H2,1-4H3

InChI Key

ZDSFYLQLWGRIGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31958334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.095

Distribution Coefficient, logD

3.095

Water Solubility, LogSw

-3.21

Polar Surface Area

48.475

Acid Dissociation Constant (pKa)

26.89

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

P218-3426 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P218-3426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P218-3426?
Check Price and Availability of P218-3426, 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 P218-3426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P218-3426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P218-3426
  • 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 P218-3426 available by request