L460-0204 Screening compound: 2-{[6-(4-methylphenyl)-4-oxo-3-propyl-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetonitrile

L460-0204 Screening compound: 2-{[6-(4-methylphenyl)-4-oxo-3-propyl-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetonitrile
L460-0204 Screening compound: 2-{[6-(4-methylphenyl)-4-oxo-3-propyl-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound L460-0204
2-{[6-(4-methylphenyl)-4-oxo-3-propyl-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetonitrile

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

L460-0204

Molecular Formula

C18H17N3OS2 (C18 H17 N3 OS2)

Compound Name

2-{[6-(4-methylphenyl)-4-oxo-3-propyl-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetonitrile

IUPAC name

2-{[6-(4-methylphenyl)-4-oxo-3-propyl-3H4H-thieno[32-d]pyrimidin-2-yl]sulfanyl}acetonitrile

SMILES

CCCN(C1=O)C(SCC#N)=Nc2c1sc(-c1ccc(C)cc1)c2

InChI

InChI=1S/C18H17N3OS2/c1-3-9-21-17(22)16-14(20-18(21)23-10-8-19)11-15(24-16)13-6-4-12(2)5-7-13/h4-7,11H,3,9-10H2,1-2H3

InChI Key

NKHLDOCNPJUFRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27254037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.482

Distribution Coefficient, logD

4.482

Water Solubility, LogSw

-4.22

Polar Surface Area

44.531

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

0.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

L460-0204 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with L460-0204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L460-0204?
Check Price and Availability of L460-0204, 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 L460-0204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L460-0204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L460-0204
  • 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 L460-0204 available by request