8009-1742 Screening compound: 3-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propanamide

8009-1742 Screening compound: 3-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propanamide
8009-1742 Screening compound: 3-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-1742
3-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propanamide

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

8009-1742

Molecular Formula

C13H15N3O2S (C13 H15 N3 O2 S)

Compound Name

3-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propanamide

IUPAC name

3-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propanamide

SMILES

NC(CCC(C(N1Cc2ccccc2)=O)NC1=S)=O

InChI

InChI=1S/C13H15N3O2S/c14-11(17)7-6-10-12(18)16(13(19)15-10)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,17)(H,15,19)/t10-/m1/s1

InChI Key

BRAAMVXSGCJHCD-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD01461728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.814

Distribution Coefficient, logD

0.814

Water Solubility, LogSw

-2.08

Polar Surface Area

62.161

Acid Dissociation Constant (pKa)

13.41

Base Dissociation Constant (pKb)

0.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.80

8009-1742 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CORONAVIRUS Library (20774 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8009-1742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-1742?
Check Price and Availability of 8009-1742, 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 8009-1742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-1742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-1742
  • 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 8009-1742 available by request