M115-0564 Screening compound: 3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methoxyphenyl)-1,4-dihydropyridazin-4-one

M115-0564 Screening compound: 3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methoxyphenyl)-1,4-dihydropyridazin-4-one
M115-0564 Screening compound: 3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methoxyphenyl)-1,4-dihydropyridazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M115-0564
3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methoxyphenyl)-1,4-dihydropyridazin-4-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

M115-0564

Molecular Formula

C19H13ClN4O3 (C19 H13 ClN4 O3)

Compound Name

3-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methoxyphenyl)-1,4-dihydropyridazin-4-one

IUPAC name

3-[3-(2-chlorophenyl)-124-oxadiazol-5-yl]-1-(4-methoxyphenyl)-14-dihydropyridazin-4-one

SMILES

COc(cc1)ccc1N(C=C1)N=C(c2nc(-c(cccc3)c3Cl)no2)C1=O

InChI

InChI=1S/C19H13ClN4O3/c1-26-13-8-6-12(7-9-13)24-11-10-16(25)17(22-24)19-21-18(23-27-19)14-4-2-3-5-15(14)20/h2-11H,1H3

InChI Key

XSMAKAFMKKSVIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27497663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.79

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.954

Distribution Coefficient, logD

3.954

Water Solubility, LogSw

-4.33

Polar Surface Area

65.598

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

2.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

M115-0564 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M115-0564 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M115-0564?
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What is the minimum amount of M115-0564 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M115-0564
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M115-0564
  • 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 M115-0564 available by request