S024-4434 Screening compound: 1-(4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}piperazin-1-yl)-3-(3-methoxyphenyl)propan-1-one

S024-4434 Screening compound: 1-(4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}piperazin-1-yl)-3-(3-methoxyphenyl)propan-1-one
S024-4434 Screening compound: 1-(4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}piperazin-1-yl)-3-(3-methoxyphenyl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S024-4434
1-(4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}piperazin-1-yl)-3-(3-methoxyphenyl)propan-1-one

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

S024-4434

Molecular Formula

C22H29N5O2 (C22 H29 N5 O2)

Compound Name

1-(4-{2-ethyl-2H,3H-imidazo[1,2-c]pyrimidin-7-yl}piperazin-1-yl)-3-(3-methoxyphenyl)propan-1-one

IUPAC name

1-(4-{2-ethyl-2H3H-imidazo[12-c]pyrimidin-7-yl}piperazin-1-yl)-3-(3-methoxyphenyl)propan-1-one

SMILES

CCC(C1)N=C2N1C=NC(N(CC1)CCN1C(CCc1cc(OC)ccc1)=O)=C2

InChI

InChI=1S/C22H29N5O2/c1-3-18-15-27-16-23-20(14-21(27)24-18)25-9-11-26(12-10-25)22(28)8-7-17-5-4-6-19(13-17)29-2/h4-6,13-14,16,18H,3,7-12,15H2,1-2H3/t18-/m1/s1

InChI Key

BKUPGRYAYSEKGW-GOSISDBHSA-N

MDL Number (MFCD)

MFCD29028604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.475

Distribution Coefficient, logD

-2.050

Water Solubility, LogSw

-2.49

Polar Surface Area

51.058

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

11.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

S024-4434 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S024-4434 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S024-4434?
Check Price and Availability of S024-4434, 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 S024-4434 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S024-4434
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S024-4434
  • 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 S024-4434 available by request