F707-2904 Screening compound: 1-{1-[3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carbonyl}azepane

F707-2904 Screening compound: 1-{1-[3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carbonyl}azepane
F707-2904 Screening compound: 1-{1-[3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carbonyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound F707-2904
1-{1-[3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carbonyl}azepane

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

F707-2904

Molecular Formula

C23H27FN6O (C23 H27 FN6 O)

Compound Name

1-{1-[3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carbonyl}azepane

IUPAC name

1-{1-[3-(2-fluorophenyl)-[124]triazolo[43-b]pyridazin-6-yl]piperidine-4-carbonyl}azepane

SMILES

O=C(C(CC1)CCN1c1nn2c(-c(cccc3)c3F)nnc2cc1)N1CCCCCC1

InChI

InChI=1S/C23H27FN6O/c24-19-8-4-3-7-18(19)22-26-25-20-9-10-21(27-30(20)22)28-15-11-17(12-16-28)23(31)29-13-5-1-2-6-14-29/h3-4,7-10,17H,1-2,5-6,11-16H2

InChI Key

BTGYCWVACARQLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14964365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.555

Distribution Coefficient, logD

3.555

Water Solubility, LogSw

-3.62

Polar Surface Area

52.292

Acid Dissociation Constant (pKa)

22.16

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

F707-2904 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with F707-2904 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F707-2904?
Check Price and Availability of F707-2904, 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 F707-2904 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F707-2904
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F707-2904
  • 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 F707-2904 available by request