G842-0571 Screening compound: 1-[(2-chlorophenyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxo-1,2-dihydropyridine-3-carboxamide

G842-0571 Screening compound: 1-[(2-chlorophenyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxo-1,2-dihydropyridine-3-carboxamide
G842-0571 Screening compound: 1-[(2-chlorophenyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxo-1,2-dihydropyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G842-0571
1-[(2-chlorophenyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxo-1,2-dihydropyridine-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

G842-0571

Molecular Formula

C21H16ClN3O2S (C21 H16 ClN3 O2 S)

Compound Name

1-[(2-chlorophenyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxo-1,2-dihydropyridine-3-carboxamide

IUPAC name

1-[(2-chlorophenyl)methyl]-N-(6-methyl-13-benzothiazol-2-yl)-2-oxo-12-dihydropyridine-3-carboxamide

SMILES

Cc(cc1)cc2c1nc(NC(C1=CC=CN(Cc(cccc3)c3Cl)C1=O)=O)s2

InChI

InChI=1S/C21H16ClN3O2S/c1-13-8-9-17-18(11-13)28-21(23-17)24-19(26)15-6-4-10-25(20(15)27)12-14-5-2-3-7-16(14)22/h2-11H,12H2,1H3,(H,23,24,26)

InChI Key

WQMGOALUTQGCPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08029377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.921

Distribution Coefficient, logD

4.607

Water Solubility, LogSw

-4.90

Polar Surface Area

48.805

Acid Dissociation Constant (pKa)

7.37

Base Dissociation Constant (pKb)

-0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

G842-0571 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Proteases Annotated Library (2868 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G842-0571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G842-0571?
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What is the minimum amount of G842-0571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G842-0571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G842-0571
  • 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 G842-0571 available by request