K940-0501 Screening compound: 2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]-N-(4-sulfamoylphenyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound K940-0501
2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]-N-(4-sulfamoylphenyl)acetamide
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
K940-0501
Molecular Formula
C18H21FN4O5S2 (C18 H21 FN4 O5 S2)
Compound Name
2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]-N-(4-sulfamoylphenyl)acetamide
IUPAC name
2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]-N-(4-sulfamoylphenyl)acetamide
SMILES
NS(c(cc1)ccc1NC(CN(CC1)CCN1S(c(cc1)ccc1F)(=O)=O)=O)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
456.52
Hydrogen Bond Acceptors Count
13.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
1.141
Distribution Coefficient, logD
1.140
Water Solubility, LogSw
-2.27
Polar Surface Area
109.242
Acid Dissociation Constant (pKa)
10.01
Base Dissociation Constant (pKb)
3.00
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
27.80
K940-0501 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Dark Chemical Matter Library (18430 compounds)
Human Kinases Annotated Library (2415 compounds)
Carbonic Anhydrase II Library (4939 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Pool
References: we are preparing a list of scientific research reports with K940-0501 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)