P511-0041 Screening compound: 1-[(4-fluorophenyl)methyl]-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one
Chemical Structure Depiction of ChemDiv screening compound P511-0041
1-[(4-fluorophenyl)methyl]-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one
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
P511-0041
Molecular Formula
C16H17FN2O3S (C16 H17 FN2 O3 S)
Compound Name
1-[(4-fluorophenyl)methyl]-5-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-2-one
IUPAC name
1-[(4-fluorophenyl)methyl]-5-(pyrrolidine-1-sulfonyl)-12-dihydropyridin-2-one
SMILES
O=C(C=C1)N(Cc(cc2)ccc2F)C=C1S(N1CCCC1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
336.39
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
1.374
Distribution Coefficient, logD
1.374
Water Solubility, LogSw
-2.36
Polar Surface Area
48.826
Acid Dissociation Constant (pKa)
27.94
Base Dissociation Constant (pKb)
-3.99
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
31.30
P511-0041 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
BRD4 Targeted Library (4534 compounds)
Dark Chemical Matter Library (18430 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
SmartTM Library (51161 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Cancer
- Hemic and lymphatic
- Cardiovascular
- Metabolic
- Epigenetic
- Others
- Pool
References: we are preparing a list of scientific research reports with P511-0041 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)