D727-0743 Screening compound: 2-[6-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]quinoline
Chemical Structure Depiction of ChemDiv screening compound D727-0743
2-[6-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]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
D727-0743
Molecular Formula
C20H15N5O2S (C20 H15 N5 O2 S)
Compound Name
2-[6-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]quinoline
IUPAC name
2-[6-(34-dimethoxyphenyl)-[124]triazolo[34-b][134]thiadiazol-3-yl]quinoline
SMILES
COc(ccc(-c(s1)nn2c1nnc2-c1nc2ccccc2cc1)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
389.44
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.564
Distribution Coefficient, logD
3.560
Water Solubility, LogSw
-3.80
Polar Surface Area
57.313
Acid Dissociation Constant (pKa)
32.86
Base Dissociation Constant (pKb)
5.38
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
10.00
D727-0743 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
C-Met Library (15277 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Regenerative Medicine Focused Library (23016 compounds)
SmartTM Library (51161 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Kinases
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with D727-0743 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)