D341-0449 Screening compound: 1-benzyl-4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazine

D341-0449 Screening compound: 1-benzyl-4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazine
D341-0449 Screening compound: 1-benzyl-4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D341-0449
1-benzyl-4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazine

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

D341-0449

Molecular Formula

C23H21ClN4S (C23 H21 ClN4 S)

Compound Name

1-benzyl-4-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazine

IUPAC name

1-benzyl-4-[5-(4-chlorophenyl)thieno[23-d]pyrimidin-4-yl]piperazine

SMILES

Clc(cc1)ccc1-c1csc2ncnc(N3CCN(Cc4ccccc4)CC3)c12

InChI

InChI=1S/C23H21ClN4S/c24-19-8-6-18(7-9-19)20-15-29-23-21(20)22(25-16-26-23)28-12-10-27(11-13-28)14-17-4-2-1-3-5-17/h1-9,15-16H,10-14H2

InChI Key

NKVKYJXOIZZEDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09496214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.97

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.808

Distribution Coefficient, logD

5.729

Water Solubility, LogSw

-6.32

Polar Surface Area

27.807

Acid Dissociation Constant (pKa)

22.05

Base Dissociation Constant (pKb)

6.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

D341-0449 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

MCL1 Targeted Library (12200 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D341-0449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D341-0449?
Check Price and Availability of D341-0449, 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 D341-0449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D341-0449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D341-0449
  • 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 D341-0449 available by request