4191-0262 Screening compound: 2-(N-benzyl3,4-dimethoxybenzenesulfonamido)-N-(5-chloro-2-methylphenyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound 4191-0262
2-(N-benzyl3,4-dimethoxybenzenesulfonamido)-N-(5-chloro-2-methylphenyl)acetamide
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
4191-0262
Molecular Formula
C24H25ClN2O5S (C24 H25 ClN2 O5 S)
Compound Name
2-(N-benzyl3,4-dimethoxybenzenesulfonamido)-N-(5-chloro-2-methylphenyl)acetamide
IUPAC name
2-(N-benzyl34-dimethoxybenzenesulfonamido)-N-(5-chloro-2-methylphenyl)acetamide
SMILES
Cc(ccc(Cl)c1)c1NC(CN(Cc1ccccc1)S(c(cc1)cc(OC)c1OC)(=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
488.99
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.252
Distribution Coefficient, logD
4.234
Water Solubility, LogSw
-4.57
Polar Surface Area
69.055
Acid Dissociation Constant (pKa)
8.76
Base Dissociation Constant (pKb)
-1.79
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.80
4191-0262 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Human Proteases Annotated Library (2868 compounds)
Selective Target Activity Profiling Library (14702 compounds)
Anti-HIV1 Library (19540 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with 4191-0262 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)