3360-9353 Screening compound: butyl 2-[2-(5-methylfuran-2-yl)quinoline-4-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

3360-9353 Screening compound: butyl 2-[2-(5-methylfuran-2-yl)quinoline-4-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
3360-9353 Screening compound: butyl 2-[2-(5-methylfuran-2-yl)quinoline-4-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3360-9353
butyl 2-[2-(5-methylfuran-2-yl)quinoline-4-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-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

3360-9353

Molecular Formula

C28H28N2O4S (C28 H28 N2 O4 S)

Compound Name

butyl 2-[2-(5-methylfuran-2-yl)quinoline-4-amido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

IUPAC name

butyl 2-[2-(5-methylfuran-2-yl)quinoline-4-amido]-4567-tetrahydro-1-benzothiophene-3-carboxylate

SMILES

CCCCOC(c1c(NC(c2cc(-c3ccc(C)o3)nc3ccccc23)=O)sc2c1CCCC2)=O

InChI

InChI=1S/C28H28N2O4S/c1-3-4-15-33-28(32)25-19-10-6-8-12-24(19)35-27(25)30-26(31)20-16-22(23-14-13-17(2)34-23)29-21-11-7-5-9-18(20)21/h5,7,9,11,13-14,16H,3-4,6,8,10,12,15H2,1-2H3,(H,30,31)

InChI Key

HNASGQWNCMPHRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01922636

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.141

Distribution Coefficient, logD

5.178

Water Solubility, LogSw

-5.83

Polar Surface Area

60.244

Acid Dissociation Constant (pKa)

5.44

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

3360-9353 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 3360-9353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3360-9353?
Check Price and Availability of 3360-9353, 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 3360-9353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3360-9353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3360-9353
  • 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 3360-9353 available by request