SA65-1454 Screening compound: N,N-dimethyl-3-{2-[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]ethyl}-1,2,4-oxadiazol-5-amine

SA65-1454 Screening compound: N,N-dimethyl-3-{2-[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]ethyl}-1,2,4-oxadiazol-5-amine
SA65-1454 Screening compound: N,N-dimethyl-3-{2-[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]ethyl}-1,2,4-oxadiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA65-1454
N,N-dimethyl-3-{2-[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]ethyl}-1,2,4-oxadiazol-5-amine

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

SA65-1454

Molecular Formula

C18H28N6O2 (C18 H28 N6 O2)

Compound Name

N,N-dimethyl-3-{2-[1-(1,3,5-trimethyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]ethyl}-1,2,4-oxadiazol-5-amine

IUPAC name

NN-dimethyl-3-{2-[1-(135-trimethyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]ethyl}-124-oxadiazol-5-amine

SMILES

Cc1c(C(N2CCC(CCc3noc(N(C)C)n3)CC2)=O)c(C)nn1C

InChI

InChI=1S/C18H28N6O2/c1-12-16(13(2)23(5)20-12)17(25)24-10-8-14(9-11-24)6-7-15-19-18(22(3)4)26-21-15/h14H,6-11H2,1-5H3

InChI Key

CBDBTMPKDUJSQQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32239055

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.964

Distribution Coefficient, logD

0.964

Water Solubility, LogSw

-1.21

Polar Surface Area

67.270

Acid Dissociation Constant (pKa)

25.88

Base Dissociation Constant (pKb)

3.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

SA65-1454 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA65-1454 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA65-1454?
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What is the minimum amount of SA65-1454 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA65-1454
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA65-1454
  • 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 SA65-1454 available by request