C769-1813 Screening compound: 6-fluoro-N-(4-fluorophenyl)-3-(4-methylbenzenesulfonyl)quinolin-4-amine
Chemical Structure Depiction of ChemDiv screening compound C769-1813
6-fluoro-N-(4-fluorophenyl)-3-(4-methylbenzenesulfonyl)quinolin-4-amine
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
C769-1813
Molecular Formula
C22H16F2N2O2S (C22 H16 F2 N2 O2 S)
Compound Name
6-fluoro-N-(4-fluorophenyl)-3-(4-methylbenzenesulfonyl)quinolin-4-amine
IUPAC name
6-fluoro-N-(4-fluorophenyl)-3-(4-methylbenzenesulfonyl)quinolin-4-amine
SMILES
Cc(cc1)ccc1S(c(cnc(c1c2)ccc2F)c1Nc(cc1)ccc1F)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
410.44
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
5.209
Distribution Coefficient, logD
5.209
Water Solubility, LogSw
-5.09
Polar Surface Area
46.108
Acid Dissociation Constant (pKa)
16.81
Base Dissociation Constant (pKb)
0.37
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
4.50
C769-1813 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Antifungal Library (16415 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Infections
- Immune system
- animal
- Epigenetic
- Agro
References: we are preparing a list of scientific research reports with C769-1813 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)