8018-9199 Screening compound: [3-(1H-imidazol-1-yl)propyl][(pyridin-4-yl)methyl]amine

8018-9199 Screening compound: [3-(1H-imidazol-1-yl)propyl][(pyridin-4-yl)methyl]amine
8018-9199 Screening compound: [3-(1H-imidazol-1-yl)propyl][(pyridin-4-yl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-9199
[3-(1H-imidazol-1-yl)propyl][(pyridin-4-yl)methyl]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

8018-9199

Molecular Formula

C12H16N4 (C12 H16 N4)

Compound Name

[3-(1H-imidazol-1-yl)propyl][(pyridin-4-yl)methyl]amine

IUPAC name

[3-(1H-imidazol-1-yl)propyl][(pyridin-4-yl)methyl]amine

SMILES

C(CNCc1ccncc1)Cn1cncc1

InChI

InChI=1S/C12H16N4/c1(8-16-9-7-15-11-16)4-14-10-12-2-5-13-6-3-12/h2-3,5-7,9,11,14H,1,4,8,10H2

InChI Key

QWKABRUIDAEGCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01475338

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

216.29

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

-0.412

Distribution Coefficient, logD

-1.396

Water Solubility, LogSw

-0.49

Polar Surface Area

34.074

Acid Dissociation Constant (pKa)

24.99

Base Dissociation Constant (pKb)

8.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8018-9199 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8018-9199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-9199?
Check Price and Availability of 8018-9199, 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 8018-9199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-9199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-9199
  • 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 8018-9199 available by request