C200-9236 Screening compound: methyl 4-(3,4-dimethylphenyl)-6,7-difluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate

C200-9236 Screening compound: methyl 4-(3,4-dimethylphenyl)-6,7-difluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
C200-9236 Screening compound: methyl 4-(3,4-dimethylphenyl)-6,7-difluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-9236
methyl 4-(3,4-dimethylphenyl)-6,7-difluoro-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

C200-9236

Molecular Formula

C18H15F2NO4S (C18 H15 F2 NO4 S)

Compound Name

methyl 4-(3,4-dimethylphenyl)-6,7-difluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate

IUPAC name

methyl 4-(34-dimethylphenyl)-67-difluoro-11-dioxo-4H-1lambda64-benzothiazine-2-carboxylate

SMILES

Cc(cc1)c(C)cc1N(C=C1C(OC)=O)c(cc(c(F)c2)F)c2S1(=O)=O

InChI

InChI=1S/C18H15F2NO4S/c1-10-4-5-12(6-11(10)2)21-9-17(18(22)25-3)26(23,24)16-8-14(20)13(19)7-15(16)21/h4-9H,1-3H3

InChI Key

XZQTUACVLVFJSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16639693

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.38

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

3.690

Distribution Coefficient, logD

3.690

Water Solubility, LogSw

-4.09

Polar Surface Area

52.124

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

-2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C200-9236 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C200-9236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-9236?
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What is the minimum amount of C200-9236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-9236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-9236
  • 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 C200-9236 available by request