P906-0964 Screening compound: 1-[4-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-8-METHYL-2,8-DIAZASPIRO[4.5]DEC-2-YL]-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-PROPANONE

P906-0964 Screening compound: 1-[4-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-8-METHYL-2,8-DIAZASPIRO[4.5]DEC-2-YL]-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-PROPANONE
P906-0964 Screening compound: 1-[4-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-8-METHYL-2,8-DIAZASPIRO[4.5]DEC-2-YL]-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-PROPANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound P906-0964
1-[4-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-8-METHYL-2,8-DIAZASPIRO[4.5]DEC-2-YL]-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-PROPANONE

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

P906-0964

Molecular Formula

C22H32N6O2 (C22 H32 N6 O2)

Compound Name

1-[4-(3-CYCLOPROPYL-1,2,4-OXADIAZOL-5-YL)-8-METHYL-2,8-DIAZASPIRO[4.5]DEC-2-YL]-3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1-PROPANONE

IUPAC name

n/a

SMILES

Cc1cc(C)nn1CCC(N(C1)CC2(CCN(C)CC2)C1c1nc(C2CC2)no1)=O

InChI

InChI=1S/C22H32N6O2/c1-15-12-16(2)28(24-15)9-6-19(29)27-13-18(21-23-20(25-30-21)17-4-5-17)22(14-27)7-10-26(3)11-8-22/h12,17-18H,4-11,13-14H2,1-3H3/t18-/m0/s1

InChI Key

QAYMMUQMORCESF-SFHVURJKSA-N

MDL Number (MFCD)

MFCD29028325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.027

Distribution Coefficient, logD

-1.017

Water Solubility, LogSw

-1.36

Polar Surface Area

65.904

Acid Dissociation Constant (pKa)

23.21

Base Dissociation Constant (pKb)

9.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.70

P906-0964 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Peptidomimetics of Beta-Turn Motifs Library (2153 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with P906-0964 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P906-0964?
Check Price and Availability of P906-0964, 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 P906-0964 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P906-0964
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P906-0964
  • 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 P906-0964 available by request