0519-0325 Screening compound: 5-methyl-3-(4-methylpiperazino)-5H-pyridazino[3,4-b][1,4]benzoxazine

0519-0325 Screening compound: 5-methyl-3-(4-methylpiperazino)-5H-pyridazino[3,4-b][1,4]benzoxazine
0519-0325 Screening compound: 5-methyl-3-(4-methylpiperazino)-5H-pyridazino[3,4-b][1,4]benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0519-0325
5-methyl-3-(4-methylpiperazino)-5H-pyridazino[3,4-b][1,4]benzoxazine

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

0519-0325

Molecular Formula

C16H19N5O (C16 H19 N5 O)

Compound Name

5-methyl-3-(4-methylpiperazino)-5H-pyridazino[3,4-b][1,4]benzoxazine

IUPAC name

9-methyl-6-(4-methylpiperazin-1-yl)-2-oxa-459-triazatricyclo[8.4.0.0^{38}]tetradeca-1(10)3571113-hexaene

SMILES

CN(CC1)CCN1c1nnc2Oc(cccc3)c3N(C)c2c1

InChI

InChI=1S/C16H19N5O/c1-19-7-9-21(10-8-19)15-11-13-16(18-17-15)22-14-6-4-3-5-12(14)20(13)2/h3-6,11H,7-10H2,1-2H3

InChI Key

SDYYIRPAZHJOLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00409223

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

297.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.923

Distribution Coefficient, logD

0.130

Water Solubility, LogSw

-2.26

Polar Surface Area

37.542

Acid Dissociation Constant (pKa)

24.26

Base Dissociation Constant (pKb)

9.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

0519-0325 in Drug Discovery

Included in Screening Libraries

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 0519-0325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0519-0325?
Check Price and Availability of 0519-0325, 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 0519-0325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0519-0325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0519-0325
  • 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 0519-0325 available by request