D072-0717 Screening compound: 1-[4-(4-fluorobenzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-phenylpiperazine
Chemical Structure Depiction of ChemDiv screening compound D072-0717
1-[4-(4-fluorobenzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-phenylpiperazine
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
D072-0717
Molecular Formula
C26H24FN3O3S (C26 H24 FN3 O3 S)
Compound Name
1-[4-(4-fluorobenzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-phenylpiperazine
IUPAC name
1-[4-(4-fluorobenzenesulfonyl)-2-(4-methylphenyl)-13-oxazol-5-yl]-4-phenylpiperazine
SMILES
Cc(cc1)ccc1-c1nc(S(c(cc2)ccc2F)(=O)=O)c(N(CC2)CCN2c2ccccc2)o1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
477.56
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.718
Distribution Coefficient, logD
5.718
Water Solubility, LogSw
-5.65
Polar Surface Area
54.739
Acid Dissociation Constant (pKa)
27.05
Base Dissociation Constant (pKb)
6.54
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
19.20
D072-0717 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
References: we are preparing a list of scientific research reports with D072-0717 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)