K890-0039 Screening compound: N2-(4-iodophenyl)-6-methoxy-N4-[2-(morpholin-4-yl)ethyl]-1,3,5-triazine-2,4-diamine

K890-0039 Screening compound: N2-(4-iodophenyl)-6-methoxy-N4-[2-(morpholin-4-yl)ethyl]-1,3,5-triazine-2,4-diamine
K890-0039 Screening compound: N2-(4-iodophenyl)-6-methoxy-N4-[2-(morpholin-4-yl)ethyl]-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound K890-0039
N2-(4-iodophenyl)-6-methoxy-N4-[2-(morpholin-4-yl)ethyl]-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

K890-0039

Molecular Formula

C16H21IN6O2 (C16 H21 IN6 O2)

Compound Name

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

IUPAC name

N2-(4-iodophenyl)-6-methoxy-N4-[2-(morpholin-4-yl)ethyl]-135-triazine-24-diamine

SMILES

COc1nc(NCCN2CCOCC2)nc(Nc(cc2)ccc2I)n1

InChI

InChI=1S/C16H21IN6O2/c1-24-16-21-14(18-6-7-23-8-10-25-11-9-23)20-15(22-16)19-13-4-2-12(17)3-5-13/h2-5H,6-11H2,1H3,(H2,18,19,20,21,22)

InChI Key

AJFANYLCUHILPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03352675

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.041

Distribution Coefficient, logD

3.953

Water Solubility, LogSw

-4.09

Polar Surface Area

70.597

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

K890-0039 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K890-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K890-0039?
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What is the minimum amount of K890-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K890-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K890-0039
  • 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 K890-0039 available by request