2683-0198 Screening compound: ethyl 6-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxohexanoate

2683-0198 Screening compound: ethyl 6-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxohexanoate
2683-0198 Screening compound: ethyl 6-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxohexanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2683-0198
ethyl 6-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxohexanoate

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

2683-0198

Molecular Formula

C18H24N4O4S (C18 H24 N4 O4 S)

Compound Name

ethyl 6-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxohexanoate

IUPAC name

ethyl 6-(5-{[(46-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-oxo-23-dihydro-1H-imidazol-4-yl)-6-oxohexanoate

SMILES

CCOC(CCCCC(C(N1)=C(CSc2nc(C)cc(C)n2)NC1=O)=O)=O

InChI

InChI=1S/C18H24N4O4S/c1-4-26-15(24)8-6-5-7-14(23)16-13(21-17(25)22-16)10-27-18-19-11(2)9-12(3)20-18/h9H,4-8,10H2,1-3H3,(H2,21,22,25)

InChI Key

MXUQGHVBDMUJLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00742652

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.800

Distribution Coefficient, logD

-1.442

Water Solubility, LogSw

-2.56

Polar Surface Area

86.145

Acid Dissociation Constant (pKa)

4.16

Base Dissociation Constant (pKb)

1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

2683-0198 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 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 2683-0198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2683-0198?
Check Price and Availability of 2683-0198, 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 2683-0198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2683-0198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2683-0198
  • 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 2683-0198 available by request