G786-1941 Screening compound: 3-(4-chlorophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-chromen-2-one
Chemical Structure Depiction of ChemDiv screening compound G786-1941
3-(4-chlorophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-chromen-2-one
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
G786-1941
Molecular Formula
C21H21ClN2O3 (C21 H21 ClN2 O3)
Compound Name
3-(4-chlorophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-chromen-2-one
IUPAC name
3-(4-chlorophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-chromen-2-one
SMILES
CN1CCN(Cc(c(O2)c(cc3)C=C(c(cc4)ccc4Cl)C2=O)c3O)CC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
384.86
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.353
Distribution Coefficient, logD
2.554
Water Solubility, LogSw
-3.78
Polar Surface Area
44.330
Acid Dissociation Constant (pKa)
8.96
Base Dissociation Constant (pKb)
8.12
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.60
G786-1941 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Antiviral Annotated Library (21441 compounds)
CORONAVIRUS Library (20774 compounds)
Hsp90-Targeted Library (11355 compounds)
PLpro Library (6343 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with G786-1941 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)