M082-0625 Screening compound: 3-bromo-5-(4-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)pyridine

M082-0625 Screening compound: 3-bromo-5-(4-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)pyridine
M082-0625 Screening compound: 3-bromo-5-(4-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound M082-0625
3-bromo-5-(4-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)pyridine

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

M082-0625

Molecular Formula

C21H21BrN4O3 (C21 H21 BrN4 O3)

Compound Name

3-bromo-5-(4-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)pyridine

IUPAC name

3-bromo-5-(4-{[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]methyl}piperidine-1-carbonyl)pyridine

SMILES

COc(cc1)ccc1-c1noc(CC(CC2)CCN2C(c2cc(Br)cnc2)=O)n1

InChI

InChI=1S/C21H21BrN4O3/c1-28-18-4-2-15(3-5-18)20-24-19(29-25-20)10-14-6-8-26(9-7-14)21(27)16-11-17(22)13-23-12-16/h2-5,11-14H,6-10H2,1H3

InChI Key

BAABPWZEXWUVNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27496460

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.33

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

4.331

Distribution Coefficient, logD

4.331

Water Solubility, LogSw

-4.17

Polar Surface Area

65.109

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M082-0625 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M082-0625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M082-0625?
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What is the minimum amount of M082-0625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M082-0625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M082-0625
  • 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 M082-0625 available by request