M043-0848 Screening compound: 2-{[6-(4-methylbenzenesulfonyl)pyridazin-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of ChemDiv screening compound M043-0848
2-{[6-(4-methylbenzenesulfonyl)pyridazin-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-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
M043-0848
Molecular Formula
C23H24N4O3S2 (C23 H24 N4 O3 S2)
Compound Name
2-{[6-(4-methylbenzenesulfonyl)pyridazin-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
IUPAC name
2-{[6-(4-methylbenzenesulfonyl)pyridazin-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
SMILES
Cc(cc1)ccc1S(c(cc1)nnc1SCC(N(CC1)CCN1c1ccccc1)=O)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
468.6
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.387
Distribution Coefficient, logD
3.387
Water Solubility, LogSw
-3.63
Polar Surface Area
69.999
Acid Dissociation Constant (pKa)
21.51
Base Dissociation Constant (pKb)
5.55
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
26.10
M043-0848 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Receptor's ligands
- Immune system
References: we are preparing a list of scientific research reports with M043-0848 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)