CM4297-7488 Screening compound: 2-(2-fluorophenyl)-1-{3-[3-(pyridin-3-yl)-4H-1,2,4-triazol-4-yl]azetidin-1-yl}ethan-1-one

CM4297-7488 Screening compound: 2-(2-fluorophenyl)-1-{3-[3-(pyridin-3-yl)-4H-1,2,4-triazol-4-yl]azetidin-1-yl}ethan-1-one
CM4297-7488 Screening compound: 2-(2-fluorophenyl)-1-{3-[3-(pyridin-3-yl)-4H-1,2,4-triazol-4-yl]azetidin-1-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4297-7488
2-(2-fluorophenyl)-1-{3-[3-(pyridin-3-yl)-4H-1,2,4-triazol-4-yl]azetidin-1-yl}ethan-1-one

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

CM4297-7488

Molecular Formula

C18H16FN5O (C18 H16 FN5 O)

Compound Name

2-(2-fluorophenyl)-1-{3-[3-(pyridin-3-yl)-4H-1,2,4-triazol-4-yl]azetidin-1-yl}ethan-1-one

IUPAC name

2-(2-fluorophenyl)-1-{3-[3-(pyridin-3-yl)-4H-124-triazol-4-yl]azetidin-1-yl}ethan-1-one

SMILES

O=C(Cc(cccc1)c1F)N(C1)CC1n1c(-c2cnccc2)nnc1

InChI

InChI=1S/C18H16FN5O/c19-16-6-2-1-4-13(16)8-17(25)23-10-15(11-23)24-12-21-22-18(24)14-5-3-7-20-9-14/h1-7,9,12,15H,8,10-11H2

InChI Key

AINSQJOFDFIMEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30459826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.198

Distribution Coefficient, logD

1.189

Water Solubility, LogSw

-0.90

Polar Surface Area

50.260

Acid Dissociation Constant (pKa)

16.67

Base Dissociation Constant (pKb)

5.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

CM4297-7488 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with CM4297-7488 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4297-7488?
Check Price and Availability of CM4297-7488, 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 CM4297-7488 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4297-7488
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4297-7488
  • 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 CM4297-7488 available by request