D420-1015 Screening compound: N,N,8-trimethyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)quinolin-2-amine
Chemical Structure Depiction of ChemDiv screening compound D420-1015
N,N,8-trimethyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)quinolin-2-amine
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
D420-1015
Molecular Formula
C20H18N4O (C20 H18 N4 O)
Compound Name
N,N,8-trimethyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)quinolin-2-amine
IUPAC name
NN8-trimethyl-3-(5-phenyl-124-oxadiazol-3-yl)quinolin-2-amine
SMILES
Cc(cccc1cc2-c3noc(-c4ccccc4)n3)c1nc2N(C)C
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
330.39
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.147
Distribution Coefficient, logD
5.019
Water Solubility, LogSw
-5.90
Polar Surface Area
43.483
Acid Dissociation Constant (pKa)
23.92
Base Dissociation Constant (pKb)
6.94
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
15.00
D420-1015 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Targeted Diversity Library (40567 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Kinases
- Agro
References: we are preparing a list of scientific research reports with D420-1015 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)