G917-0091 Screening compound: methyl 6-fluoro-4-(4-methoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate

G917-0091 Screening compound: methyl 6-fluoro-4-(4-methoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
G917-0091 Screening compound: methyl 6-fluoro-4-(4-methoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G917-0091
methyl 6-fluoro-4-(4-methoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate

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

G917-0091

Molecular Formula

C17H14FNO5S (C17 H14 FNO5 S)

Compound Name

methyl 6-fluoro-4-(4-methoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate

IUPAC name

methyl 6-fluoro-4-(4-methoxyphenyl)-11-dioxo-4H-1lambda64-benzothiazine-2-carboxylate

SMILES

COC(C1=CN(c(cc2)ccc2OC)c(cc(cc2)F)c2S1(=O)=O)=O

InChI

InChI=1S/C17H14FNO5S/c1-23-13-6-4-12(5-7-13)19-10-16(17(20)24-2)25(21,22)15-8-3-11(18)9-14(15)19/h3-10H,1-2H3

InChI Key

DQRJDSYYPDQNHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27167942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.220

Distribution Coefficient, logD

2.220

Water Solubility, LogSw

-2.79

Polar Surface Area

59.668

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-2.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

G917-0091 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

BRD4 Targeted Library (4534 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with G917-0091 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G917-0091?
Check Price and Availability of G917-0091, 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 G917-0091 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G917-0091
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G917-0091
  • 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 G917-0091 available by request