G856-5620 Screening compound: N~8~-cyclohexyl-N~8~-ethyl-2-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound G856-5620
N~8~-cyclohexyl-N~8~-ethyl-2-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonamide
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
G856-5620
Molecular Formula
C19H26N2O3S (C19 H26 N2 O3 S)
Compound Name
N~8~-cyclohexyl-N~8~-ethyl-2-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonamide
IUPAC name
N-cyclohexyl-N-ethyl-2-oxo-1-azatricyclo[6.3.1.0^{412}]dodeca-468(12)-triene-6-sulfonamide
SMILES
CCN(C1CCCCC1)S(c(cc1C2)cc(CCC3)c1N3C2=O)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
362.49
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.185
Distribution Coefficient, logD
3.185
Water Solubility, LogSw
-3.36
Polar Surface Area
49.225
Acid Dissociation Constant (pKa)
11.78
Base Dissociation Constant (pKb)
-2.68
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
63.20
G856-5620 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS MPO Library (28609 compounds)
Hsp90-Targeted Library (11355 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Nervous system
- Cancer
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
References: we are preparing a list of scientific research reports with G856-5620 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)