P158-0775 Screening compound: N-methyl-2-[2-oxo-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]-N-phenylacetamide
Chemical Structure Depiction of ChemDiv screening compound P158-0775
N-methyl-2-[2-oxo-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]-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
P158-0775
Molecular Formula
C18H21N3O4S (C18 H21 N3 O4 S)
Compound Name
N-methyl-2-[2-oxo-3-(pyrrolidine-1-sulfonyl)-1,2-dihydropyridin-1-yl]-N-phenylacetamide
IUPAC name
N-methyl-2-[2-oxo-3-(pyrrolidine-1-sulfonyl)-12-dihydropyridin-1-yl]-N-phenylacetamide
SMILES
CN(C(CN(C=CC=C1S(N2CCCC2)(=O)=O)C1=O)=O)c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
375.45
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
0.479
Distribution Coefficient, logD
0.479
Water Solubility, LogSw
-2.03
Polar Surface Area
63.143
Acid Dissociation Constant (pKa)
23.94
Base Dissociation Constant (pKb)
-1.31
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
P158-0775 in Drug Discovery
Included in Screening Libraries
CNS MPO Library (28609 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Included in 1.7M Stock Database
- Nervous system
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with P158-0775 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)