S024-4601 Screening compound: 4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide

S024-4601 Screening compound: 4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide
S024-4601 Screening compound: 4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S024-4601
4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide

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

S024-4601

Molecular Formula

C20H26N6OS (C20 H26 N6 OS)

Compound Name

4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide

IUPAC name

4-{2-ethyl-2H3H-imidazo[12-c]pyrimidin-7-yl}-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide

SMILES

CCC(C1)N=C2N1C=NC(N(CC1)CCN1C(Nc(cc1)ccc1SC)=O)=C2

InChI

InChI=1S/C20H26N6OS/c1-3-15-13-26-14-21-18(12-19(26)22-15)24-8-10-25(11-9-24)20(27)23-16-4-6-17(28-2)7-5-16/h4-7,12,14-15H,3,8-11,13H2,1-2H3,(H,23,27)/t15-/m1/s1

InChI Key

ORKYYXJTZBHIOO-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD29028624

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.967

Distribution Coefficient, logD

-1.558

Water Solubility, LogSw

-3.48

Polar Surface Area

52.862

Acid Dissociation Constant (pKa)

13.68

Base Dissociation Constant (pKb)

11.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

S024-4601 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S024-4601 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S024-4601?
Check Price and Availability of S024-4601, 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 S024-4601 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S024-4601
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S024-4601
  • 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 S024-4601 available by request