C515-0196 Screening compound: methyl 4-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamido)benzoate

C515-0196 Screening compound: methyl 4-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamido)benzoate
C515-0196 Screening compound: methyl 4-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C515-0196
methyl 4-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamido)benzoate

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

C515-0196

Molecular Formula

C18H17N3O6S (C18 H17 N3 O6 S)

Compound Name

methyl 4-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamido)benzoate

IUPAC name

methyl 4-(14-dimethyl-23-dioxo-1234-tetrahydroquinoxaline-6-sulfonamido)benzoate

SMILES

CN(c(ccc(S(Nc(cc1)ccc1C(OC)=O)(=O)=O)c1)c1N(C)C1=O)C1=O

InChI

InChI=1S/C18H17N3O6S/c1-20-14-9-8-13(10-15(14)21(2)17(23)16(20)22)28(25,26)19-12-6-4-11(5-7-12)18(24)27-3/h4-10,19H,1-3H3

InChI Key

HNYBLBYIIGDAFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14763604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.42

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.365

Distribution Coefficient, logD

1.224

Water Solubility, LogSw

-2.52

Polar Surface Area

92.421

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

-3.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C515-0196 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Antiviral Library (67538 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C515-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C515-0196?
Check Price and Availability of C515-0196, 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 C515-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C515-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C515-0196
  • 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 C515-0196 available by request