S751-1516 Screening compound: N-[2-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)ethyl]-1-phenylcyclopentane-1-carboxamide

S751-1516 Screening compound: N-[2-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)ethyl]-1-phenylcyclopentane-1-carboxamide
S751-1516 Screening compound: N-[2-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)ethyl]-1-phenylcyclopentane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S751-1516
N-[2-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)ethyl]-1-phenylcyclopentane-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

S751-1516

Molecular Formula

C22H29N3O (C22 H29 N3 O)

Compound Name

N-[2-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)ethyl]-1-phenylcyclopentane-1-carboxamide

IUPAC name

N-[2-(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)ethyl]-1-phenylcyclopentane-1-carboxamide

SMILES

Cc1cnc(C2CCC2)n1CCNC(C1(CCCC1)c1ccccc1)=O

InChI

InChI=1S/C22H29N3O/c1-17-16-24-20(18-8-7-9-18)25(17)15-14-23-21(26)22(12-5-6-13-22)19-10-3-2-4-11-19/h2-4,10-11,16,18H,5-9,12-15H2,1H3,(H,23,26)

InChI Key

YBKPHZQUVGMDOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32227741

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.312

Distribution Coefficient, logD

0.766

Water Solubility, LogSw

-3.17

Polar Surface Area

36.466

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

9.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.54

S751-1516 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S751-1516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S751-1516?
Check Price and Availability of S751-1516, 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 S751-1516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S751-1516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S751-1516
  • 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 S751-1516 available by request