G853-0127 Screening compound: 2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinolin-1-yl]-N-phenylacetamide

G853-0127 Screening compound: 2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinolin-1-yl]-N-phenylacetamide
G853-0127 Screening compound: 2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinolin-1-yl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G853-0127
2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinolin-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

G853-0127

Molecular Formula

C21H21N3O4S (C21 H21 N3 O4 S)

Compound Name

2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinolin-1-yl]-N-phenylacetamide

IUPAC name

2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-12-dihydroquinolin-1-yl]-N-phenylacetamide

SMILES

O=C(CN(c(cc1)c(C=C2)cc1S(N1CCCC1)(=O)=O)C2=O)Nc1ccccc1

InChI

InChI=1S/C21H21N3O4S/c25-20(22-17-6-2-1-3-7-17)15-24-19-10-9-18(14-16(19)8-11-21(24)26)29(27,28)23-12-4-5-13-23/h1-3,6-11,14H,4-5,12-13,15H2,(H,22,25)

InChI Key

HLSNHJDGCMCTDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15040880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.496

Distribution Coefficient, logD

2.496

Water Solubility, LogSw

-3.07

Polar Surface Area

70.845

Acid Dissociation Constant (pKa)

12.78

Base Dissociation Constant (pKb)

1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G853-0127 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G853-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G853-0127?
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What is the minimum amount of G853-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G853-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G853-0127
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of G853-0127 available by request