T473-0978F Screening compound: 7-{4-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]piperazino}[1,2,4]triazolo[4,3-b]pyridazine

T473-0978F Screening compound: 7-{4-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]piperazino}[1,2,4]triazolo[4,3-b]pyridazine
T473-0978F Screening compound: 7-{4-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]piperazino}[1,2,4]triazolo[4,3-b]pyridazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T473-0978F
7-{4-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]piperazino}[1,2,4]triazolo[4,3-b]pyridazine

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

T473-0978F

Molecular Formula

C20H23N7O (C20 H23 N7 O)

Compound Name

7-{4-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]piperazino}[1,2,4]triazolo[4,3-b]pyridazine

IUPAC name

5-methoxy-1-methyl-3-[(4-{[124]triazolo[43-b]pyridazin-7-yl}piperazin-1-yl)methyl]-1H-indole

SMILES

Cn1c(ccc(OC)c2)c2c(CN(CC2)CCN2c2cc3nncn3nc2)c1

InChI

InChI=1S/C20H23N7O/c1-24-12-15(18-10-17(28-2)3-4-19(18)24)13-25-5-7-26(8-6-25)16-9-20-23-21-14-27(20)22-11-16/h3-4,9-12,14H,5-8,13H2,1-2H3

InChI Key

VLGCJHRHDDCGDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030926

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.422

Distribution Coefficient, logD

-0.176

Water Solubility, LogSw

-1.91

Polar Surface Area

50.640

Acid Dissociation Constant (pKa)

26.52

Base Dissociation Constant (pKb)

8.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

T473-0978F in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T473-0978F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T473-0978F?
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What is the minimum amount of T473-0978F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T473-0978F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T473-0978F
  • 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 T473-0978F available by request