S024-4122 Screening compound: 4-{2-methyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide

S024-4122 Screening compound: 4-{2-methyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide
S024-4122 Screening compound: 4-{2-methyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[2-(trifluoromethyl)phenyl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S024-4122
4-{2-methyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}-N-[2-(trifluoromethyl)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

S024-4122

Molecular Formula

C19H21F3N6O (C19 H21 F3 N6 O)

Compound Name

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

IUPAC name

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

SMILES

CC(C1)N=C2N1C=NC(N(CC1)CCN1C(Nc1c(C(F)(F)F)cccc1)=O)=C2

InChI

InChI=1S/C19H21F3N6O/c1-13-11-28-12-23-16(10-17(28)24-13)26-6-8-27(9-7-26)18(29)25-15-5-3-2-4-14(15)19(20,21)22/h2-5,10,12-13H,6-9,11H2,1H3,(H,25,29)/t13-/m1/s1

InChI Key

KVBNOCRYUHIWQL-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD29028558

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.724

Distribution Coefficient, logD

-2.043

Water Solubility, LogSw

-3.50

Polar Surface Area

51.557

Acid Dissociation Constant (pKa)

13.79

Base Dissociation Constant (pKb)

12.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

S024-4122 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)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S024-4122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S024-4122?
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What is the minimum amount of S024-4122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S024-4122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S024-4122
  • 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 S024-4122 available by request