J038-0347 Screening compound: 9-chloro-5-(2-ethoxyphenyl)-2H,3H,4H,4aH,5H,6H,10bH-pyrano[3,2-c]quinoline
Chemical Structure Depiction of ChemDiv screening compound J038-0347
9-chloro-5-(2-ethoxyphenyl)-2H,3H,4H,4aH,5H,6H,10bH-pyrano[3,2-c]quinoline
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
J038-0347
Molecular Formula
C20H22ClNO2 (C20 H22 ClNO2)
Compound Name
9-chloro-5-(2-ethoxyphenyl)-2H,3H,4H,4aH,5H,6H,10bH-pyrano[3,2-c]quinoline
IUPAC name
(4aS10bS)-9-chloro-5-(2-ethoxyphenyl)-2H3H4H4aH5H6H10bH-pyrano[32-c]quinoline
SMILES
CCOc1c(C([C@H]2[C@@H]3OCCC2)Nc(cc2)c3cc2Cl)cccc1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
343.85
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
4.908
Distribution Coefficient, logD
4.908
Water Solubility, LogSw
-4.88
Polar Surface Area
28.040
Acid Dissociation Constant (pKa)
16.96
Base Dissociation Constant (pKb)
2.02
Number of Chiral Centers
3.00
Percent sp3 carbon bonding
40.00
J038-0347 in Drug Discovery
Included in Screening Libraries
3D Mimetics PPI Library (1617 compounds)
Anti-Aging Library (44940 compounds)
KRAS-Targeted Library (16000 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Protein-Protein Interaction Library (218420 compounds)
Targeted Diversity Library (40567 compounds)
Antibacterial Compounds Library (13827 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Mimetics
- 3D
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Infections
- Immune system
- animal
- Epigenetic
- PPI modulators
- Kinases
- Kinases
References: we are preparing a list of scientific research reports with J038-0347 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)