D341-0411 Screening compound: ethyl 1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate

D341-0411 Screening compound: ethyl 1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate
D341-0411 Screening compound: ethyl 1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D341-0411
ethyl 1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-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

D341-0411

Molecular Formula

C21H23N3O2S (C21 H23 N3 O2 S)

Compound Name

ethyl 1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[5-(4-methylphenyl)thieno[23-d]pyrimidin-4-yl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1c1c(c(-c2ccc(C)cc2)cs2)c2ncn1)=O

InChI

InChI=1S/C21H23N3O2S/c1-3-26-21(25)16-8-10-24(11-9-16)19-18-17(12-27-20(18)23-13-22-19)15-6-4-14(2)5-7-15/h4-7,12-13,16H,3,8-11H2,1-2H3

InChI Key

UKCDBYIXLZOQMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12914780

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.232

Distribution Coefficient, logD

5.228

Water Solubility, LogSw

-5.05

Polar Surface Area

45.021

Acid Dissociation Constant (pKa)

20.75

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

D341-0411 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with D341-0411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D341-0411?
Check Price and Availability of D341-0411, 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 D341-0411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D341-0411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D341-0411
  • 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 D341-0411 available by request