G682-0240 Screening compound: 2-[6-chloro-4-(2-fluorophenyl)-1,1-dioxo-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl]-N~1~-cyclopentylacetamide

G682-0240 Screening compound: 2-[6-chloro-4-(2-fluorophenyl)-1,1-dioxo-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl]-N~1~-cyclopentylacetamide
G682-0240 Screening compound: 2-[6-chloro-4-(2-fluorophenyl)-1,1-dioxo-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl]-N~1~-cyclopentylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G682-0240
2-[6-chloro-4-(2-fluorophenyl)-1,1-dioxo-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl]-N~1~-cyclopentylacetamide

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

G682-0240

Molecular Formula

C20H19ClFN3O3S (C20 H19 ClFN3 O3 S)

Compound Name

2-[6-chloro-4-(2-fluorophenyl)-1,1-dioxo-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl]-N~1~-cyclopentylacetamide

IUPAC name

2-[6-chloro-4-(2-fluorophenyl)-11-dioxo-2H-1lambda623-benzothiadiazin-2-yl]-N-cyclopentylacetamide

SMILES

O=C(CN(N=C(c(cccc1)c1F)c1c2ccc(Cl)c1)S2(=O)=O)NC1CCCC1

InChI

InChI=1S/C20H19ClFN3O3S/c21-13-9-10-18-16(11-13)20(15-7-3-4-8-17(15)22)24-25(29(18,27)28)12-19(26)23-14-5-1-2-6-14/h3-4,7-11,14H,1-2,5-6,12H2,(H,23,26)

InChI Key

XCFKAGSWZLNPHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15029125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.188

Distribution Coefficient, logD

4.188

Water Solubility, LogSw

-4.57

Polar Surface Area

65.266

Acid Dissociation Constant (pKa)

16.46

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

G682-0240 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G682-0240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G682-0240?
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What is the minimum amount of G682-0240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G682-0240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G682-0240
  • 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 G682-0240 available by request