C176-0244 Screening compound: 4-(BENZENESULFONYL)-5-(ETHYLSULFANYL)-2-(THIOPHEN-2-YL)-1,3-OXAZOLE
Chemical Structure Depiction of ChemDiv screening compound C176-0244
4-(BENZENESULFONYL)-5-(ETHYLSULFANYL)-2-(THIOPHEN-2-YL)-1,3-OXAZOLE
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
C176-0244
Molecular Formula
C15H13NO3S3 (C15 H13 NO3 S3)
Compound Name
4-(BENZENESULFONYL)-5-(ETHYLSULFANYL)-2-(THIOPHEN-2-YL)-1,3-OXAZOLE
IUPAC name
n/a
SMILES
CCSc(oc(-c1cccs1)n1)c1S(c1ccccc1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
351.47
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.384
Distribution Coefficient, logD
4.384
Water Solubility, LogSw
-4.30
Polar Surface Area
48.958
Acid Dissociation Constant (pKa)
29.89
Base Dissociation Constant (pKb)
-7.65
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
13.30
C176-0244 in Drug Discovery
Included in Screening Libraries
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with C176-0244 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)