8014-9255 Screening compound: 4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl cyanide

8014-9255 Screening compound: 4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl cyanide
8014-9255 Screening compound: 4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9255
4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl cyanide

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

8014-9255

Molecular Formula

C12H16N6 (C12 H16 N6)

Compound Name

4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl cyanide

IUPAC name

bis(pyrrolidin-1-yl)-135-triazine-2-carbonitrile

SMILES

N#Cc1nc(N2CCCC2)nc(N2CCCC2)n1

InChI

InChI=1S/C12H16N6/c13-9-10-14-11(17-5-1-2-6-17)16-12(15-10)18-7-3-4-8-18/h1-8H2

InChI Key

ZWWZJOQFJBLWJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03820991

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

244.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.126

Distribution Coefficient, logD

3.126

Water Solubility, LogSw

-2.98

Polar Surface Area

53.642

Acid Dissociation Constant (pKa)

18.25

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

8014-9255 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Fragments Library (11262 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Kinases Annotated Library (2415 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8014-9255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9255?
Check Price and Availability of 8014-9255, 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 8014-9255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9255
  • 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 8014-9255 available by request