C565-0115 Screening compound: ethyl 4-[2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamido]benzoate

C565-0115 Screening compound: ethyl 4-[2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamido]benzoate
C565-0115 Screening compound: ethyl 4-[2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C565-0115
ethyl 4-[2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamido]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

C565-0115

Molecular Formula

C26H25N3O6S (C26 H25 N3 O6 S)

Compound Name

ethyl 4-[2-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamido]benzoate

IUPAC name

ethyl 4-[2-(2-oxo-1234-tetrahydroquinoline-6-sulfonamido)-2-phenylacetamido]benzoate

SMILES

CCOC(c(cc1)ccc1NC(C(c1ccccc1)NS(c(cc1)cc(CC2)c1NC2=O)(=O)=O)=O)=O

InChI

InChI=1S/C26H25N3O6S/c1-2-35-26(32)18-8-11-20(12-9-18)27-25(31)24(17-6-4-3-5-7-17)29-36(33,34)21-13-14-22-19(16-21)10-15-23(30)28-22/h3-9,11-14,16,24,29H,2,10,15H2,1H3,(H,27,31)(H,28,30)/t24-/m1/s1

InChI Key

QTSFSVIEEFMTRD-XMMPIXPASA-N

MDL Number (MFCD)

MFCD14772351

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.57

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.488

Distribution Coefficient, logD

3.484

Water Solubility, LogSw

-3.79

Polar Surface Area

110.228

Acid Dissociation Constant (pKa)

9.46

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

C565-0115 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C565-0115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C565-0115?
Check Price and Availability of C565-0115, 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 C565-0115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C565-0115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C565-0115
  • 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 C565-0115 available by request