M115-1609 Screening compound: 1-(3-bromophenyl)-3-[3-(2-bromophenyl)-1,2,4-oxadiazol-5-yl]-1,4-dihydropyridazin-4-one

M115-1609 Screening compound: 1-(3-bromophenyl)-3-[3-(2-bromophenyl)-1,2,4-oxadiazol-5-yl]-1,4-dihydropyridazin-4-one
M115-1609 Screening compound: 1-(3-bromophenyl)-3-[3-(2-bromophenyl)-1,2,4-oxadiazol-5-yl]-1,4-dihydropyridazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M115-1609
1-(3-bromophenyl)-3-[3-(2-bromophenyl)-1,2,4-oxadiazol-5-yl]-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

M115-1609

Molecular Formula

C18H10Br2N4O2 (C18 H10 Br2 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(C=C1)C(c2nc(-c(cccc3)c3Br)no2)=NN1c1cc(Br)ccc1

InChI

InChI=1S/C18H10Br2N4O2/c19-11-4-3-5-12(10-11)24-9-8-15(25)16(22-24)18-21-17(23-26-18)13-6-1-2-7-14(13)20/h1-10H

InChI Key

BTIXDXIQHYFQKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27497736

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.11

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.588

Distribution Coefficient, logD

4.588

Water Solubility, LogSw

-4.63

Polar Surface Area

58.055

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

3.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

M115-1609 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M115-1609 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M115-1609?
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What is the minimum amount of M115-1609 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M115-1609
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M115-1609
  • 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 M115-1609 available by request