G743-0002 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzamide

G743-0002 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzamide
G743-0002 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G743-0002
N~1~-(3-chloro-4-fluorophenyl)-4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzamide

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

G743-0002

Molecular Formula

C20H15ClFN3O3S (C20 H15 ClFN3 O3 S)

Compound Name

N~1~-(3-chloro-4-fluorophenyl)-4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-4-(11-dioxo-34-dihydro-2H-1lambda624-benzothiadiazin-3-yl)benzamide

SMILES

O=C(c1ccc(C(Nc2c3cccc2)NS3(=O)=O)cc1)Nc(cc1)cc(Cl)c1F

InChI

InChI=1S/C20H15ClFN3O3S/c21-15-11-14(9-10-16(15)22)23-20(26)13-7-5-12(6-8-13)19-24-17-3-1-2-4-18(17)29(27,28)25-19/h1-11,19,24-25H,(H,23,26)/t19-/m0/s1

InChI Key

MDZDKYOBMYBZKI-IBGZPJMESA-N

MDL Number (MFCD)

MFCD15031082

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.87

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.421

Distribution Coefficient, logD

3.137

Water Solubility, LogSw

-3.99

Polar Surface Area

75.192

Acid Dissociation Constant (pKa)

7.43

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

5.00

G743-0002 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G743-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G743-0002?
Check Price and Availability of G743-0002, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G743-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G743-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G743-0002
  • 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 G743-0002 available by request