C769-1073 Screening compound: 6-methyl-3-(4-methylbenzenesulfonyl)-4-(4-phenylpiperazin-1-yl)quinoline
Chemical Structure Depiction of ChemDiv screening compound C769-1073
6-methyl-3-(4-methylbenzenesulfonyl)-4-(4-phenylpiperazin-1-yl)quinoline
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
C769-1073
Molecular Formula
C27H27N3O2S (C27 H27 N3 O2 S)
Compound Name
6-methyl-3-(4-methylbenzenesulfonyl)-4-(4-phenylpiperazin-1-yl)quinoline
IUPAC name
6-methyl-3-(4-methylbenzenesulfonyl)-4-(4-phenylpiperazin-1-yl)quinoline
SMILES
Cc(cc1)ccc1S(c(cnc1ccc(C)cc11)c1N(CC1)CCN1c1ccccc1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
457.6
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.909
Distribution Coefficient, logD
5.909
Water Solubility, LogSw
-5.52
Polar Surface Area
44.703
Acid Dissociation Constant (pKa)
25.91
Base Dissociation Constant (pKb)
2.76
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.20
C769-1073 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Included in 1.7M Stock Database
- Immune system
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Epigenetic
References: we are preparing a list of scientific research reports with C769-1073 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)