K511-0018 Screening compound: 6-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound K511-0018
6-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
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
K511-0018
Molecular Formula
C20H18FN3O5S (C20 H18 FN3 O5 S)
Compound Name
6-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
IUPAC name
6-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}-4-oxo-14-dihydroquinoline-3-carboxylic acid
SMILES
OC(C1=CNc(ccc(S(N(CC2)CCN2c(cccc2)c2F)(=O)=O)c2)c2C1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
431.44
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
1.751
Distribution Coefficient, logD
-0.926
Water Solubility, LogSw
-2.87
Polar Surface Area
87.436
Acid Dissociation Constant (pKa)
4.72
Base Dissociation Constant (pKb)
4.08
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.00
K511-0018 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Agro
References: we are preparing a list of scientific research reports with K511-0018 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)