8561-07680 Screening compound: N2-(4-chlorophenyl)-6-[(quinolin-8-yloxy)methyl]-1,3,5-triazine-2,4-diamine

8561-07680 Screening compound: N2-(4-chlorophenyl)-6-[(quinolin-8-yloxy)methyl]-1,3,5-triazine-2,4-diamine
8561-07680 Screening compound: N2-(4-chlorophenyl)-6-[(quinolin-8-yloxy)methyl]-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8561-07680
N2-(4-chlorophenyl)-6-[(quinolin-8-yloxy)methyl]-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

8561-07680

Molecular Formula

C19H15ClN6O (C19 H15 ClN6 O)

Compound Name

N2-(4-chlorophenyl)-6-[(quinolin-8-yloxy)methyl]-1,3,5-triazine-2,4-diamine

IUPAC name

N2-(4-chlorophenyl)-6-[(quinolin-8-yloxy)methyl]-135-triazine-24-diamine

SMILES

Nc1nc(COc2cccc3cccnc23)nc(Nc(cc2)ccc2Cl)n1

InChI

InChI=1S/C19H15ClN6O/c20-13-6-8-14(9-7-13)23-19-25-16(24-18(21)26-19)11-27-15-5-1-3-12-4-2-10-22-17(12)15/h1-10H,11H2,(H3,21,23,24,25,26)

InChI Key

UJVLUVWQSFJTKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07181191

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.82

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.045

Distribution Coefficient, logD

4.038

Water Solubility, LogSw

-4.39

Polar Surface Area

78.456

Acid Dissociation Constant (pKa)

15.85

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

8561-07680 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antifungal Library (16415 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
  • Agro
Targets:
  • Proteases
  • Kinases

References: we are preparing a list of scientific research reports with 8561-07680 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8561-07680?
Check Price and Availability of 8561-07680, 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 8561-07680 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8561-07680
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8561-07680
  • 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 8561-07680 available by request