S360-0679 Screening compound: 3-(3,4-dimethoxyphenyl)-3'-(pyridin-3-yl)-5,5'-bi-1,2,4-oxadiazole
Chemical Structure Depiction of ChemDiv screening compound S360-0679
3-(3,4-dimethoxyphenyl)-3'-(pyridin-3-yl)-5,5'-bi-1,2,4-oxadiazole
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
S360-0679
Molecular Formula
C17H13N5O4 (C17 H13 N5 O4)
Compound Name
3-(3,4-dimethoxyphenyl)-3'-(pyridin-3-yl)-5,5'-bi-1,2,4-oxadiazole
IUPAC name
n/a
SMILES
COc(ccc(-c1noc(-c2nc(-c3cnccc3)no2)n1)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
351.32
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
2.722
Distribution Coefficient, logD
2.667
Water Solubility, LogSw
-2.76
Polar Surface Area
88.100
Acid Dissociation Constant (pKa)
32.43
Base Dissociation Constant (pKb)
6.53
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.80
S360-0679 in Drug Discovery
Included in Screening Libraries
Ligand-Gated Ion Channels Library (3887 compounds)
MEF2-HDAC (class II) Modulators Library (5147 compounds)
Included in 1.7M Stock Database
- Nervous system
- Eye
- Cancer
- Musculoskeletal
- Female
- Hemic and lymphatic
- Cardiovascular
- Ion Channels
- PPI modulators
- Epigenetic
References: we are preparing a list of scientific research reports with S360-0679 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)