4814-0005 Screening compound: 6-chloro-N4-[2-(morpholin-4-yl)ethyl]-N2,N2-dipropyl-1,3,5-triazine-2,4-diamine

4814-0005 Screening compound: 6-chloro-N4-[2-(morpholin-4-yl)ethyl]-N2,N2-dipropyl-1,3,5-triazine-2,4-diamine
4814-0005 Screening compound: 6-chloro-N4-[2-(morpholin-4-yl)ethyl]-N2,N2-dipropyl-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4814-0005
6-chloro-N4-[2-(morpholin-4-yl)ethyl]-N2,N2-dipropyl-1,3,5-triazine-2,4-diamine

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

4814-0005

Molecular Formula

C15H27ClN6O (C15 H27 ClN6 O)

Compound Name

6-chloro-N4-[2-(morpholin-4-yl)ethyl]-N2,N2-dipropyl-1,3,5-triazine-2,4-diamine

IUPAC name

6-chloro-N4-[2-(morpholin-4-yl)ethyl]-N2N2-dipropyl-135-triazine-24-diamine

SMILES

CCCN(CCC)c1nc(NCCN2CCOCC2)nc(Cl)n1

InChI

InChI=1S/C15H27ClN6O/c1-3-6-22(7-4-2)15-19-13(16)18-14(20-15)17-5-8-21-9-11-23-12-10-21/h3-12H2,1-2H3,(H,17,18,19,20)

InChI Key

XIFOMDGKXWMWAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01615605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.353

Distribution Coefficient, logD

3.264

Water Solubility, LogSw

-3.85

Polar Surface Area

55.110

Acid Dissociation Constant (pKa)

13.89

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

80.00

4814-0005 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4814-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4814-0005?
Check Price and Availability of 4814-0005, 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 4814-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4814-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4814-0005
  • 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 4814-0005 available by request