8014-9250 Screening compound: (E)-N'-hydroxy-4,6-bis(pyrrolidin-1-yl)-1,3,5-triazine-2-carboximidamide

8014-9250 Screening compound: (E)-N'-hydroxy-4,6-bis(pyrrolidin-1-yl)-1,3,5-triazine-2-carboximidamide
8014-9250 Screening compound: (E)-N'-hydroxy-4,6-bis(pyrrolidin-1-yl)-1,3,5-triazine-2-carboximidamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9250
(E)-N'-hydroxy-4,6-bis(pyrrolidin-1-yl)-1,3,5-triazine-2-carboximidamide

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

8014-9250

Molecular Formula

C12H19N7O (C12 H19 N7 O)

Compound Name

(E)-N'-hydroxy-4,6-bis(pyrrolidin-1-yl)-1,3,5-triazine-2-carboximidamide

IUPAC name

(E)-N'-hydroxy-46-bis(pyrrolidin-1-yl)-135-triazine-2-carboximidamide

SMILES

N/C(/c1nc(N2CCCC2)nc(N2CCCC2)n1)=N/O

InChI

InChI=1S/C12H19N7O/c13-9(17-20)10-14-11(18-5-1-2-6-18)16-12(15-10)19-7-3-4-8-19/h20H,1-8H2,(H2,13,17)

InChI Key

LYTDARULBIWMSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03820986

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.054

Distribution Coefficient, logD

0.945

Water Solubility, LogSw

-2.00

Polar Surface Area

85.350

Acid Dissociation Constant (pKa)

8.96

Base Dissociation Constant (pKb)

8.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

8014-9250 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8014-9250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9250?
Check Price and Availability of 8014-9250, 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 8014-9250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9250
  • 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 8014-9250 available by request