M348-0268 Screening compound: 1-({3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazol-4-yl}sulfonyl)azepane

M348-0268 Screening compound: 1-({3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazol-4-yl}sulfonyl)azepane
M348-0268 Screening compound: 1-({3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazol-4-yl}sulfonyl)azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound M348-0268
1-({3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazol-4-yl}sulfonyl)azepane

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

M348-0268

Molecular Formula

C22H27N5O2S (C22 H27 N5 O2 S)

Compound Name

1-({3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazol-4-yl}sulfonyl)azepane

IUPAC name

1-({35-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazol-4-yl}sulfonyl)azepane

SMILES

Cc(n(-c(cc1)nnc1-c1ccc(C)cc1)nc1C)c1S(N1CCCCCC1)(=O)=O

InChI

InChI=1S/C22H27N5O2S/c1-16-8-10-19(11-9-16)20-12-13-21(24-23-20)27-18(3)22(17(2)25-27)30(28,29)26-14-6-4-5-7-15-26/h8-13H,4-7,14-15H2,1-3H3

InChI Key

OGLOIGNBULLCTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27538061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.620

Distribution Coefficient, logD

3.564

Water Solubility, LogSw

-3.69

Polar Surface Area

67.633

Acid Dissociation Constant (pKa)

25.77

Base Dissociation Constant (pKb)

6.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

M348-0268 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M348-0268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M348-0268?
Check Price and Availability of M348-0268, 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 M348-0268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M348-0268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M348-0268
  • 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 M348-0268 available by request