T473-0416 Screening compound: 4-{3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-7-yl}-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide

T473-0416 Screening compound: 4-{3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-7-yl}-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide
T473-0416 Screening compound: 4-{3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-7-yl}-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T473-0416
4-{3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-7-yl}-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide

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

T473-0416

Molecular Formula

C19H23N7O (C19 H23 N7 O)

Compound Name

4-{3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-7-yl}-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide

IUPAC name

4-{3-methyl-[124]triazolo[43-b]pyridazin-7-yl}-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide

SMILES

Cc1nnc2n1ncc(N(CC1)CCN1C(NCc1ccc(C)cc1)=O)c2

InChI

InChI=1S/C19H23N7O/c1-14-3-5-16(6-4-14)12-20-19(27)25-9-7-24(8-10-25)17-11-18-23-22-15(2)26(18)21-13-17/h3-6,11,13H,7-10,12H2,1-2H3,(H,20,27)

InChI Key

RBHSECVVLUTFJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29024752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.991

Distribution Coefficient, logD

0.991

Water Solubility, LogSw

-1.94

Polar Surface Area

63.721

Acid Dissociation Constant (pKa)

14.51

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

T473-0416 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with T473-0416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T473-0416?
Check Price and Availability of T473-0416, 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 T473-0416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T473-0416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T473-0416
  • 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 T473-0416 available by request