8397-0270 Screening compound: methyl 3-{[(8-hydroxyquinolin-7-yl)(pyridin-2-yl)methyl]amino}benzoate
Chemical Structure Depiction of ChemDiv screening compound 8397-0270
methyl 3-{[(8-hydroxyquinolin-7-yl)(pyridin-2-yl)methyl]amino}benzoate
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
8397-0270
Molecular Formula
C23H19N3O3 (C23 H19 N3 O3)
Compound Name
methyl 3-{[(8-hydroxyquinolin-7-yl)(pyridin-2-yl)methyl]amino}benzoate
IUPAC name
methyl 3-{[(8-hydroxyquinolin-7-yl)(pyridin-2-yl)methyl]amino}benzoate
SMILES
COC(c1cc(NC(c(ccc2cccnc22)c2O)c2ncccc2)ccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
385.42
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.085
Distribution Coefficient, logD
4.084
Water Solubility, LogSw
-3.96
Polar Surface Area
64.788
Acid Dissociation Constant (pKa)
10.20
Base Dissociation Constant (pKb)
4.34
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
8.70
8397-0270 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Chelators targeting matrix metalloproteinases library (8930 compounds)
DGK Inhibitors Library (10558 compounds)
Targeted Diversity Library (40567 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Cardiovascular
- Cancer
- Digestive system
- Hemic and lymphatic
- Skin
- Metabolic
- Immune system
- Proteases
- Kinases
References: we are preparing a list of scientific research reports with 8397-0270 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)