K890-0064 Screening compound: 6-methoxy-N2-[2-(morpholin-4-yl)ethyl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine

K890-0064 Screening compound: 6-methoxy-N2-[2-(morpholin-4-yl)ethyl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine
K890-0064 Screening compound: 6-methoxy-N2-[2-(morpholin-4-yl)ethyl]-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound K890-0064
6-methoxy-N2-[2-(morpholin-4-yl)ethyl]-N4-(4-nitrophenyl)-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

K890-0064

Molecular Formula

C16H21N7O4 (C16 H21 N7 O4)

Compound Name

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

IUPAC name

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

SMILES

COc1nc(NCCN2CCOCC2)nc(Nc(cc2)ccc2[N+]([O-])=O)n1

InChI

InChI=1S/C16H21N7O4/c1-26-16-20-14(17-6-7-22-8-10-27-11-9-22)19-15(21-16)18-12-2-4-13(5-3-12)23(24)25/h2-5H,6-11H2,1H3,(H2,17,18,19,20,21)

InChI Key

RTKXEADWBVLDSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15111146

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.39

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.756

Distribution Coefficient, logD

2.668

Water Solubility, LogSw

-3.24

Polar Surface Area

103.979

Acid Dissociation Constant (pKa)

13.28

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

K890-0064 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 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 K890-0064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K890-0064?
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What is the minimum amount of K890-0064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K890-0064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K890-0064
  • 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 K890-0064 available by request