T473-0682 Screening compound: 1-[4-(propan-2-yl)benzenesulfonyl]-4-{[1,2,4]triazolo[4,3-b]pyridazin-7-yl}piperazine

T473-0682 Screening compound: 1-[4-(propan-2-yl)benzenesulfonyl]-4-{[1,2,4]triazolo[4,3-b]pyridazin-7-yl}piperazine
T473-0682 Screening compound: 1-[4-(propan-2-yl)benzenesulfonyl]-4-{[1,2,4]triazolo[4,3-b]pyridazin-7-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T473-0682
1-[4-(propan-2-yl)benzenesulfonyl]-4-{[1,2,4]triazolo[4,3-b]pyridazin-7-yl}piperazine

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

T473-0682

Molecular Formula

C18H22N6O2S (C18 H22 N6 O2 S)

Compound Name

1-[4-(propan-2-yl)benzenesulfonyl]-4-{[1,2,4]triazolo[4,3-b]pyridazin-7-yl}piperazine

IUPAC name

1-[4-(propan-2-yl)benzenesulfonyl]-4-{[124]triazolo[43-b]pyridazin-7-yl}piperazine

SMILES

CC(C)c(cc1)ccc1S(N(CC1)CCN1c1cc2nncn2nc1)(=O)=O

InChI

InChI=1S/C18H22N6O2S/c1-14(2)15-3-5-17(6-4-15)27(25,26)23-9-7-22(8-10-23)16-11-18-21-19-13-24(18)20-12-16/h3-6,11-14H,7-10H2,1-2H3

InChI Key

AVILGIQWIFYOHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29025660

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.172

Distribution Coefficient, logD

2.172

Water Solubility, LogSw

-2.52

Polar Surface Area

68.515

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

T473-0682 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T473-0682 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T473-0682?
Check Price and Availability of T473-0682, 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 T473-0682 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T473-0682
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T473-0682
  • 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 T473-0682 available by request