S751-0005 Screening compound: 2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethan-1-amine

S751-0005 Screening compound: 2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethan-1-amine
S751-0005 Screening compound: 2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethan-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound S751-0005
2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethan-1-amine

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

S751-0005

Molecular Formula

C11H14N4 (C11 H14 N4)

Compound Name

2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethan-1-amine

IUPAC name

2-[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]ethan-1-amine

SMILES

Cc1cnc(-c2ccncc2)n1CCN

InChI

InChI=1S/C11H14N4/c1-9-8-14-11(15(9)7-4-12)10-2-5-13-6-3-10/h2-3,5-6,8H,4,7,12H2,1H3

InChI Key

DSHRLCHGQMQGBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29018600

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

202.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.343

Distribution Coefficient, logD

-0.234

Water Solubility, LogSw

-0.24

Polar Surface Area

41.985

Acid Dissociation Constant (pKa)

23.05

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

S751-0005 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
  • Fragments
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular

References: we are preparing a list of scientific research reports with S751-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S751-0005?
Check Price and Availability of S751-0005, 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 S751-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S751-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S751-0005
  • 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 S751-0005 available by request