S751-0962 Screening compound: N-{2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethyl}-3-[2-(morpholin-4-yl)pyridin-4-yl]propanamide

S751-0962 Screening compound: N-{2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethyl}-3-[2-(morpholin-4-yl)pyridin-4-yl]propanamide
S751-0962 Screening compound: N-{2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethyl}-3-[2-(morpholin-4-yl)pyridin-4-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S751-0962
N-{2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethyl}-3-[2-(morpholin-4-yl)pyridin-4-yl]propanamide

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

S751-0962

Molecular Formula

C23H28N6O2 (C23 H28 N6 O2)

Compound Name

N-{2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethyl}-3-[2-(morpholin-4-yl)pyridin-4-yl]propanamide

IUPAC name

N-{2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethyl}-3-[2-(morpholin-4-yl)pyridin-4-yl]propanamide

SMILES

Cc1cnc(-c2ccncc2)n1CCNC(CCc1cc(N2CCOCC2)ncc1)=O

InChI

InChI=1S/C23H28N6O2/c1-18-17-27-23(20-5-7-24-8-6-20)29(18)11-10-26-22(30)3-2-19-4-9-25-21(16-19)28-12-14-31-15-13-28/h4-9,16-17H,2-3,10-15H2,1H3,(H,26,30)

InChI Key

QBTCFQFVQWMNNZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31967129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.615

Distribution Coefficient, logD

1.577

Water Solubility, LogSw

-1.47

Polar Surface Area

64.744

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

6.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.13

S751-0962 in Drug Discovery

Included in Screening Libraries

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

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with S751-0962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S751-0962?
Check Price and Availability of S751-0962, 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 S751-0962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S751-0962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S751-0962
  • 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 S751-0962 available by request