6442-0092 Screening compound: 6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-phenyl-2,3-dihydropyridazin-3-one

6442-0092 Screening compound: 6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-phenyl-2,3-dihydropyridazin-3-one
6442-0092 Screening compound: 6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-phenyl-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6442-0092
6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-phenyl-2,3-dihydropyridazin-3-one

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

6442-0092

Molecular Formula

C21H25N7O3 (C21 H25 N7 O3)

Compound Name

6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-phenyl-2,3-dihydropyridazin-3-one

IUPAC name

6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-135-triazin-2-yl]oxy}-2-phenyl-23-dihydropyridazin-3-one

SMILES

CC(C)(C)Nc1nc(OC(C=C2)=NN(c3ccccc3)C2=O)nc(N2CCOCC2)n1

InChI

InChI=1S/C21H25N7O3/c1-21(2,3)25-18-22-19(27-11-13-30-14-12-27)24-20(23-18)31-16-9-10-17(29)28(26-16)15-7-5-4-6-8-15/h4-10H,11-14H2,1-3H3,(H,22,23,24,25)

InChI Key

GZKUECONSXRYTI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06013475

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.566

Distribution Coefficient, logD

3.566

Water Solubility, LogSw

-3.70

Polar Surface Area

85.652

Acid Dissociation Constant (pKa)

15.95

Base Dissociation Constant (pKb)

8.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

6442-0092 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 6442-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6442-0092?
Check Price and Availability of 6442-0092, 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 6442-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6442-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6442-0092
  • 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 6442-0092 available by request