SA67-0062 Screening compound: 1-{3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one

SA67-0062 Screening compound: 1-{3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one
SA67-0062 Screening compound: 1-{3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA67-0062
1-{3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-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

SA67-0062

Molecular Formula

C18H27N5O2 (C18 H27 N5 O2)

Compound Name

1-{3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one

IUPAC name

1-{3-[2-(5-methyl-124-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}-3-(135-trimethyl-1H-pyrazol-4-yl)propan-1-one

SMILES

Cc1c(CCC(N2CC(CCc3noc(C)n3)CC2)=O)c(C)nn1C

InChI

InChI=1S/C18H27N5O2/c1-12-16(13(2)22(4)20-12)6-8-18(24)23-10-9-15(11-23)5-7-17-19-14(3)25-21-17/h15H,5-11H2,1-4H3/t15-/m1/s1

InChI Key

BIVMPASTJLWZLZ-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD32002493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.224

Distribution Coefficient, logD

1.224

Water Solubility, LogSw

-1.32

Polar Surface Area

63.394

Acid Dissociation Constant (pKa)

22.19

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

SA67-0062 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SA67-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA67-0062?
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What is the minimum amount of SA67-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA67-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA67-0062
  • 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 SA67-0062 available by request