S751-0309 Screening compound: N-[2-(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)ethyl]-2-(1H-indol-3-yl)acetamide

S751-0309 Screening compound: N-[2-(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)ethyl]-2-(1H-indol-3-yl)acetamide
S751-0309 Screening compound: N-[2-(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)ethyl]-2-(1H-indol-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S751-0309
N-[2-(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)ethyl]-2-(1H-indol-3-yl)acetamide

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

S751-0309

Molecular Formula

C19H22N4O (C19 H22 N4 O)

Compound Name

N-[2-(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)ethyl]-2-(1H-indol-3-yl)acetamide

IUPAC name

N-[2-(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)ethyl]-2-(1H-indol-3-yl)acetamide

SMILES

Cc1cnc(C2CC2)n1CCNC(Cc1c[nH]c2c1cccc2)=O

InChI

InChI=1S/C19H22N4O/c1-13-11-22-19(14-6-7-14)23(13)9-8-20-18(24)10-15-12-21-17-5-3-2-4-16(15)17/h2-5,11-12,14,21H,6-10H2,1H3,(H,20,24)

InChI Key

MCSTYSKKFYKQNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31994830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.413

Distribution Coefficient, logD

-1.078

Water Solubility, LogSw

-2.56

Polar Surface Area

45.837

Acid Dissociation Constant (pKa)

14.34

Base Dissociation Constant (pKb)

10.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

S751-0309 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S751-0309 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S751-0309?
Check Price and Availability of S751-0309, 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 S751-0309 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S751-0309
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S751-0309
  • 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 S751-0309 available by request