D284-0099 Screening compound: 1-(4-fluorobenzyl)-4-methyl-1H-[1,2,3]triazolo[4,5-d]pyridazin-7-ol

D284-0099 Screening compound: 1-(4-fluorobenzyl)-4-methyl-1H-[1,2,3]triazolo[4,5-d]pyridazin-7-ol
D284-0099 Screening compound: 1-(4-fluorobenzyl)-4-methyl-1H-[1,2,3]triazolo[4,5-d]pyridazin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D284-0099
1-(4-fluorobenzyl)-4-methyl-1H-[1,2,3]triazolo[4,5-d]pyridazin-7-ol

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

D284-0099

Molecular Formula

C12H10FN5O (C12 H10 FN5 O)

Compound Name

1-(4-fluorobenzyl)-4-methyl-1H-[1,2,3]triazolo[4,5-d]pyridazin-7-ol

IUPAC name

n/a

SMILES

Cc(nn1)c2nnn(Cc(cc3)ccc3F)c2c1O

InChI

InChI=1S/C12H10FN5O/c1-7-10-11(12(19)16-14-7)18(17-15-10)6-8-2-4-9(13)5-3-8/h2-5H,6H2,1H3,(H,16,19)

InChI Key

UIATWCWVTXJPKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

259.24

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.429

Distribution Coefficient, logD

-2.747

Water Solubility, LogSw

-0.99

Polar Surface Area

65.491

Acid Dissociation Constant (pKa)

4.22

Base Dissociation Constant (pKb)

3.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.00

D284-0099 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
  • Fragments
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D284-0099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D284-0099?
Check Price and Availability of D284-0099, 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 D284-0099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D284-0099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D284-0099
  • 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 D284-0099 available by request