8018-4539 Screening compound: N~8~-(2-ethoxyethyl)-3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonamide

8018-4539 Screening compound: N~8~-(2-ethoxyethyl)-3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonamide
8018-4539 Screening compound: N~8~-(2-ethoxyethyl)-3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-4539
N~8~-(2-ethoxyethyl)-3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonamide

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

8018-4539

Molecular Formula

C15H20N2O5S (C15 H20 N2 O5 S)

Compound Name

N~8~-(2-ethoxyethyl)-3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonamide

IUPAC name

N-(2-ethoxyethyl)-2-oxo-4-oxa-1-azatricyclo[7.3.1.0^{513}]trideca-579(13)-triene-8-sulfonamide

SMILES

CCOCCNS(c(cc1)c(CCCN23)c2c1OCC3=O)(=O)=O

InChI

InChI=1S/C15H20N2O5S/c1-2-21-9-7-16-23(19,20)13-6-5-12-15-11(13)4-3-8-17(15)14(18)10-22-12/h5-6,16H,2-4,7-10H2,1H3

InChI Key

QCMLLGNGSGJQGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07658894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.908

Distribution Coefficient, logD

0.908

Water Solubility, LogSw

-2.30

Polar Surface Area

75.774

Acid Dissociation Constant (pKa)

11.25

Base Dissociation Constant (pKb)

-2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.33

8018-4539 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8018-4539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-4539?
Check Price and Availability of 8018-4539, 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 8018-4539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-4539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-4539
  • 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 8018-4539 available by request