G917-0076 Screening compound: methyl 4-(2,3-dimethylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate

G917-0076 Screening compound: methyl 4-(2,3-dimethylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
G917-0076 Screening compound: methyl 4-(2,3-dimethylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G917-0076
methyl 4-(2,3-dimethylphenyl)-6-fluoro-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

G917-0076

Molecular Formula

C18H16FNO4S (C18 H16 FNO4 S)

Compound Name

methyl 4-(2,3-dimethylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate

IUPAC name

methyl 4-(23-dimethylphenyl)-6-fluoro-11-dioxo-4H-1lambda64-benzothiazine-2-carboxylate

SMILES

Cc1cccc(N(C=C2C(OC)=O)c(cc(cc3)F)c3S2(=O)=O)c1C

InChI

InChI=1S/C18H16FNO4S/c1-11-5-4-6-14(12(11)2)20-10-17(18(21)24-3)25(22,23)16-8-7-13(19)9-15(16)20/h4-10H,1-3H3

InChI Key

FYAMWLXLLCFTGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27167939

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.179

Distribution Coefficient, logD

3.179

Water Solubility, LogSw

-3.51

Polar Surface Area

51.823

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

-2.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

G917-0076 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G917-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G917-0076?
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What is the minimum amount of G917-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G917-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G917-0076
  • 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 G917-0076 available by request