M082-0891 Screening compound: 4-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)-1-(4-methylphenyl)pyrrolidin-2-one

M082-0891 Screening compound: 4-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)-1-(4-methylphenyl)pyrrolidin-2-one
M082-0891 Screening compound: 4-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)-1-(4-methylphenyl)pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M082-0891
4-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)-1-(4-methylphenyl)pyrrolidin-2-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

M082-0891

Molecular Formula

C26H27ClN4O3 (C26 H27 ClN4 O3)

Compound Name

4-(4-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)-1-(4-methylphenyl)pyrrolidin-2-one

IUPAC name

4-(4-{[3-(4-chlorophenyl)-124-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)-1-(4-methylphenyl)pyrrolidin-2-one

SMILES

Cc(cc1)ccc1N(CC(C1)C(N2CCC(Cc3nc(-c(cc4)ccc4Cl)no3)CC2)=O)C1=O

InChI

InChI=1S/C26H27ClN4O3/c1-17-2-8-22(9-3-17)31-16-20(15-24(31)32)26(33)30-12-10-18(11-13-30)14-23-28-25(29-34-23)19-4-6-21(27)7-5-19/h2-9,18,20H,10-16H2,1H3/t20-/m0/s1

InChI Key

HCSPOBLROLORAD-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27496468

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.98

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.142

Distribution Coefficient, logD

5.142

Water Solubility, LogSw

-5.68

Polar Surface Area

64.708

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

-1.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with M082-0891 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M082-0891?
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What is the minimum amount of M082-0891 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M082-0891
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M082-0891
  • 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 M082-0891 available by request