D269-0305 Screening compound: 2-(4-fluorophenoxy)-N-[3-(4-fluorophenyl)-1,2,4-thiadiazol-5-yl]butanamide
Chemical Structure Depiction of ChemDiv screening compound D269-0305
2-(4-fluorophenoxy)-N-[3-(4-fluorophenyl)-1,2,4-thiadiazol-5-yl]butanamide
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
D269-0305
Molecular Formula
C18H15F2N3O2S (C18 H15 F2 N3 O2 S)
Compound Name
2-(4-fluorophenoxy)-N-[3-(4-fluorophenyl)-1,2,4-thiadiazol-5-yl]butanamide
IUPAC name
2-(4-fluorophenoxy)-N-[3-(4-fluorophenyl)-124-thiadiazol-5-yl]butanamide
SMILES
CCC(C(Nc1nc(-c(cc2)ccc2F)ns1)=O)Oc(cc1)ccc1F
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
375.4
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.959
Distribution Coefficient, logD
4.958
Water Solubility, LogSw
-4.57
Polar Surface Area
50.589
Acid Dissociation Constant (pKa)
10.32
Base Dissociation Constant (pKb)
-5.57
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
16.70
D269-0305 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
CNS targets activity set (6557 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with D269-0305 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)