C769-1199 Screening compound: 3-(benzenesulfonyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinoline
Chemical Structure Depiction of ChemDiv screening compound C769-1199
3-(benzenesulfonyl)-4-[4-(2-methoxyphenyl)piperazin-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
C769-1199
Molecular Formula
C26H25N3O3S (C26 H25 N3 O3 S)
Compound Name
3-(benzenesulfonyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinoline
IUPAC name
3-(benzenesulfonyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinoline
SMILES
COc(cccc1)c1N(CC1)CCN1c(c1ccccc1nc1)c1S(c1ccccc1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
459.57
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.654
Distribution Coefficient, logD
4.654
Water Solubility, LogSw
-4.32
Polar Surface Area
52.032
Acid Dissociation Constant (pKa)
25.91
Base Dissociation Constant (pKb)
3.31
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
19.20
References: we are preparing a list of scientific research reports with C769-1199 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)