G857-0822 Screening compound: N'-[2-(4-chlorophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-N-(2-hydroxypropyl)ethanediamide
Chemical Structure Depiction of ChemDiv screening compound G857-0822
N'-[2-(4-chlorophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-N-(2-hydroxypropyl)ethanediamide
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
G857-0822
Molecular Formula
C16H17ClN4O3S (C16 H17 ClN4 O3 S)
Compound Name
N'-[2-(4-chlorophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-N-(2-hydroxypropyl)ethanediamide
IUPAC name
N'-[2-(4-chlorophenyl)-2H4H6H-thieno[34-c]pyrazol-3-yl]-N-(2-hydroxypropyl)ethanediamide
SMILES
CC(CNC(C(Nc1c(CSC2)c2nn1-c(cc1)ccc1Cl)=O)=O)O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
380.85
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.255
Distribution Coefficient, logD
0.230
Water Solubility, LogSw
-2.46
Polar Surface Area
80.065
Acid Dissociation Constant (pKa)
6.42
Base Dissociation Constant (pKb)
1.37
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
31.30
G857-0822 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with G857-0822 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)