8015-4868 Screening compound: 6-{[6-(benzyloxy)pyridazin-3-yl]oxy}-N2,N4-diethyl-1,3,5-triazine-2,4-diamine

8015-4868 Screening compound: 6-{[6-(benzyloxy)pyridazin-3-yl]oxy}-N2,N4-diethyl-1,3,5-triazine-2,4-diamine
8015-4868 Screening compound: 6-{[6-(benzyloxy)pyridazin-3-yl]oxy}-N2,N4-diethyl-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-4868
6-{[6-(benzyloxy)pyridazin-3-yl]oxy}-N2,N4-diethyl-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

8015-4868

Molecular Formula

C18H21N7O2 (C18 H21 N7 O2)

Compound Name

6-{[6-(benzyloxy)pyridazin-3-yl]oxy}-N2,N4-diethyl-1,3,5-triazine-2,4-diamine

IUPAC name

6-{[6-(benzyloxy)pyridazin-3-yl]oxy}-N2N4-diethyl-135-triazine-24-diamine

SMILES

CCNc1nc(Oc(cc2)nnc2OCc2ccccc2)nc(NCC)n1

InChI

InChI=1S/C18H21N7O2/c1-3-19-16-21-17(20-4-2)23-18(22-16)27-15-11-10-14(24-25-15)26-12-13-8-6-5-7-9-13/h5-11H,3-4,12H2,1-2H3,(H2,19,20,21,22,23)

InChI Key

FEAQYCLFFWGKRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03707451

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.761

Distribution Coefficient, logD

3.761

Water Solubility, LogSw

-4.15

Polar Surface Area

87.957

Acid Dissociation Constant (pKa)

17.59

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

8015-4868 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8015-4868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-4868?
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What is the minimum amount of 8015-4868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-4868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-4868
  • 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 8015-4868 available by request