L107-0444 Screening compound: 3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-1,2-dihydropyridin-2-one
Chemical Structure Depiction of ChemDiv screening compound L107-0444
3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-1,2-dihydropyridin-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
L107-0444
Molecular Formula
C24H19BrN4O3 (C24 H19 BrN4 O3)
Compound Name
3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-1,2-dihydropyridin-2-one
IUPAC name
3-[3-(4-bromophenyl)-124-oxadiazol-5-yl]-1-[2-oxo-2-(1234-tetrahydroquinolin-1-yl)ethyl]-12-dihydropyridin-2-one
SMILES
O=C(CN(C=CC=C1c2nc(-c(cc3)ccc3Br)no2)C1=O)N(CCC1)c2c1cccc2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
491.34
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.461
Distribution Coefficient, logD
4.461
Water Solubility, LogSw
-4.47
Polar Surface Area
62.416
Acid Dissociation Constant (pKa)
23.64
Base Dissociation Constant (pKb)
-0.02
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
16.70
L107-0444 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Antiviral Library (67538 compounds)
SmartTM Library (51161 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with L107-0444 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)