0724-0049 Screening compound: N-{[(5Z)-3-ethyl-4-oxo-2-sulfanylidene-1,3-oxazolidin-5-ylidene]methyl}-N-phenylacetamide
Chemical Structure Depiction of ChemDiv screening compound 0724-0049
N-{[(5Z)-3-ethyl-4-oxo-2-sulfanylidene-1,3-oxazolidin-5-ylidene]methyl}-N-phenylacetamide
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
0724-0049
Molecular Formula
C14H14N2O3S (C14 H14 N2 O3 S)
Compound Name
N-{[(5Z)-3-ethyl-4-oxo-2-sulfanylidene-1,3-oxazolidin-5-ylidene]methyl}-N-phenylacetamide
IUPAC name
N-{[(5Z)-3-ethyl-4-oxo-2-sulfanylidene-13-oxazolidin-5-ylidene]methyl}-N-phenylacetamide
SMILES
CCN(C(/C(/O1)=C/N(C(C)=O)c2ccccc2)=O)C1=S
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
290.34
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
1.223
Distribution Coefficient, logD
1.223
Water Solubility, LogSw
-2.10
Polar Surface Area
41.426
Acid Dissociation Constant (pKa)
21.66
Base Dissociation Constant (pKb)
1.55
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
21.40
0724-0049 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Agro
References: we are preparing a list of scientific research reports with 0724-0049 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)