G533-1652 Screening compound: 1-(4-fluorophenyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-oxopyrrolidine-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound G533-1652
1-(4-fluorophenyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-oxopyrrolidine-3-carboxamide
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
G533-1652
Molecular Formula
C20H21FN2O2S (C20 H21 FN2 O2 S)
Compound Name
1-(4-fluorophenyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-oxopyrrolidine-3-carboxamide
IUPAC name
1-(4-fluorophenyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-oxopyrrolidine-3-carboxamide
SMILES
CSc1ccc(CCNC(C(CCN2c(cc3)ccc3F)C2=O)=O)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
372.46
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.040
Distribution Coefficient, logD
0.746
Water Solubility, LogSw
-3.40
Polar Surface Area
41.032
Acid Dissociation Constant (pKa)
5.11
Base Dissociation Constant (pKb)
-1.58
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
30.00
G533-1652 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Antiviral Library (67538 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Antiviral
- Infections
- Immune system
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Epigenetic
- Epigenetic
References: we are preparing a list of scientific research reports with G533-1652 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)