P222-0956 Screening compound: 2-{1-[(4-methoxyphenyl)sulfonyl]-4-piperidyl}-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one

P222-0956 Screening compound: 2-{1-[(4-methoxyphenyl)sulfonyl]-4-piperidyl}-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
P222-0956 Screening compound: 2-{1-[(4-methoxyphenyl)sulfonyl]-4-piperidyl}-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P222-0956
2-{1-[(4-methoxyphenyl)sulfonyl]-4-piperidyl}-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-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

P222-0956

Molecular Formula

C20H26N4O4S (C20 H26 N4 O4 S)

Compound Name

2-{1-[(4-methoxyphenyl)sulfonyl]-4-piperidyl}-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one

IUPAC name

n/a

SMILES

CN(CCCn1nc(C(CC2)CCN2S(c(cc2)ccc2OC)(=O)=O)cc11)C1=O

InChI

InChI=1S/C20H26N4O4S/c1-22-10-3-11-24-19(20(22)25)14-18(21-24)15-8-12-23(13-9-15)29(26,27)17-6-4-16(28-2)5-7-17/h4-7,14-15H,3,8-13H2,1-2H3

InChI Key

DSLMRHCLVDLFSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27569880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.439

Distribution Coefficient, logD

1.439

Water Solubility, LogSw

-2.47

Polar Surface Area

69.352

Acid Dissociation Constant (pKa)

26.40

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P222-0956 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Hsp90-Targeted Library (11355 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with P222-0956 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P222-0956?
Check Price and Availability of P222-0956, 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 P222-0956 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P222-0956
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P222-0956
  • 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 P222-0956 available by request