Y050-1192 Screening compound: 4-[1-(2,5-dimethoxybenzenesulfonyl)piperidine-3-carbonyl]morpholine
Chemical Structure Depiction of ChemDiv screening compound Y050-1192
4-[1-(2,5-dimethoxybenzenesulfonyl)piperidine-3-carbonyl]morpholine
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
Y050-1192
Molecular Formula
C18H26N2O6S (C18 H26 N2 O6 S)
Compound Name
4-[1-(2,5-dimethoxybenzenesulfonyl)piperidine-3-carbonyl]morpholine
IUPAC name
4-[1-(25-dimethoxybenzenesulfonyl)piperidine-3-carbonyl]morpholine
SMILES
COc(cc1)cc(S(N(CCC2)CC2C(N2CCOCC2)=O)(=O)=O)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
398.48
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
0.873
Distribution Coefficient, logD
0.873
Water Solubility, LogSw
-2.22
Polar Surface Area
71.614
Acid Dissociation Constant (pKa)
22.98
Base Dissociation Constant (pKb)
-2.47
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
61.10
Y050-1192 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Antiviral Annotated Library (21441 compounds)
Dark Chemical Matter Library (18430 compounds)
Immunological Library (6760 compounds)
SmartTM Library (51161 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
- Immune system
References: we are preparing a list of scientific research reports with Y050-1192 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)