M115-0173 Screening compound: 1-(4-methylphenyl)-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]-4(1H)-pyridazinone

M115-0173 Screening compound: 1-(4-methylphenyl)-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]-4(1H)-pyridazinone
M115-0173 Screening compound: 1-(4-methylphenyl)-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]-4(1H)-pyridazinone alternative view

Chemical Structure Depiction of ChemDiv screening compound M115-0173
1-(4-methylphenyl)-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]-4(1H)-pyridazinone

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

M115-0173

Molecular Formula

C18H13N5O2 (C18 H13 N5 O2)

Compound Name

1-(4-methylphenyl)-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]-4(1H)-pyridazinone

IUPAC name

1-(4-methylphenyl)-3-[3-(pyridin-4-yl)-124-oxadiazol-5-yl]-14-dihydropyridazin-4-one

SMILES

Cc(cc1)ccc1N(C=C1)N=C(c2nc(-c3ccncc3)no2)C1=O

InChI

InChI=1S/C18H13N5O2/c1-12-2-4-14(5-3-12)23-11-8-15(24)16(21-23)18-20-17(22-25-18)13-6-9-19-10-7-13/h2-11H,1H3

InChI Key

ZYJQLQMXCDCSOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27497606

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.980

Distribution Coefficient, logD

2.980

Water Solubility, LogSw

-2.89

Polar Surface Area

67.483

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.56

M115-0173 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M115-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M115-0173?
Check Price and Availability of M115-0173, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M115-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M115-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M115-0173
  • 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 M115-0173 available by request