K844-0879 Screening compound: 1-ETHYL-4-HYDROXY-2-OXO-N-(TETRAHYDRO-2-FURANYLMETHYL)-1,2-DIHYDRO-3-QUINOLINECARBOXAMIDE

K844-0879 Screening compound: 1-ETHYL-4-HYDROXY-2-OXO-N-(TETRAHYDRO-2-FURANYLMETHYL)-1,2-DIHYDRO-3-QUINOLINECARBOXAMIDE
K844-0879 Screening compound: 1-ETHYL-4-HYDROXY-2-OXO-N-(TETRAHYDRO-2-FURANYLMETHYL)-1,2-DIHYDRO-3-QUINOLINECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound K844-0879
1-ETHYL-4-HYDROXY-2-OXO-N-(TETRAHYDRO-2-FURANYLMETHYL)-1,2-DIHYDRO-3-QUINOLINECARBOXAMIDE

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

K844-0879

Molecular Formula

C17H20N2O4 (C17 H20 N2 O4)

Compound Name

1-ETHYL-4-HYDROXY-2-OXO-N-(TETRAHYDRO-2-FURANYLMETHYL)-1,2-DIHYDRO-3-QUINOLINECARBOXAMIDE

IUPAC name

n/a

SMILES

CCN(c(cccc1)c1C(O)=C1C(NCC2OCCC2)=O)C1=O

InChI

InChI=1S/C17H20N2O4/c1-2-19-13-8-4-3-7-12(13)15(20)14(17(19)22)16(21)18-10-11-6-5-9-23-11/h3-4,7-8,11,20H,2,5-6,9-10H2,1H3,(H,18,21)/t11-/m1/s1

InChI Key

LXHUAIQNCMEWNU-LLVKDONJSA-N

MDL Number (MFCD)

MFCD01079592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.487

Distribution Coefficient, logD

-1.919

Water Solubility, LogSw

-2.39

Polar Surface Area

63.476

Acid Dissociation Constant (pKa)

5.00

Base Dissociation Constant (pKb)

-0.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

K844-0879 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with K844-0879 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K844-0879?
Check Price and Availability of K844-0879, 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 K844-0879 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K844-0879
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K844-0879
  • 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 K844-0879 available by request