F195-0371 Screening compound: ethyl 3-{2-[3-(4-chlorobenzenesulfonyl)-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl]acetamido}benzoate
Chemical Structure Depiction of ChemDiv screening compound F195-0371
ethyl 3-{2-[3-(4-chlorobenzenesulfonyl)-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl]acetamido}benzoate
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
F195-0371
Molecular Formula
C24H23ClN2O6S (C24 H23 ClN2 O6 S)
Compound Name
ethyl 3-{2-[3-(4-chlorobenzenesulfonyl)-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl]acetamido}benzoate
IUPAC name
ethyl 3-{2-[3-(4-chlorobenzenesulfonyl)-46-dimethyl-2-oxo-12-dihydropyridin-1-yl]acetamido}benzoate
SMILES
CCOC(c1cccc(NC(CN(C(C)=CC(C)=C2S(c(cc3)ccc3Cl)(=O)=O)C2=O)=O)c1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
502.98
Hydrogen Bond Acceptors Count
11.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.553
Distribution Coefficient, logD
4.553
Water Solubility, LogSw
-4.61
Polar Surface Area
88.831
Acid Dissociation Constant (pKa)
12.13
Base Dissociation Constant (pKb)
-1.88
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.80
F195-0371 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
PPI Inhibitors Tripeptide Mimetics (23972 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- PPI modulators
- Epigenetic
- Mimetics
References: we are preparing a list of scientific research reports with F195-0371 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)