CM4297-7498 Screening compound: 3-{4-[1-(5-chloro-2-methoxybenzoyl)azetidin-3-yl]-4H-1,2,4-triazol-3-yl}pyridine

CM4297-7498 Screening compound: 3-{4-[1-(5-chloro-2-methoxybenzoyl)azetidin-3-yl]-4H-1,2,4-triazol-3-yl}pyridine
CM4297-7498 Screening compound: 3-{4-[1-(5-chloro-2-methoxybenzoyl)azetidin-3-yl]-4H-1,2,4-triazol-3-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4297-7498
3-{4-[1-(5-chloro-2-methoxybenzoyl)azetidin-3-yl]-4H-1,2,4-triazol-3-yl}pyridine

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

CM4297-7498

Molecular Formula

C18H16ClN5O2 (C18 H16 ClN5 O2)

Compound Name

3-{4-[1-(5-chloro-2-methoxybenzoyl)azetidin-3-yl]-4H-1,2,4-triazol-3-yl}pyridine

IUPAC name

3-{4-[1-(5-chloro-2-methoxybenzoyl)azetidin-3-yl]-4H-124-triazol-3-yl}pyridine

SMILES

COc(ccc(Cl)c1)c1C(N(C1)CC1n1c(-c2cnccc2)nnc1)=O

InChI

InChI=1S/C18H16ClN5O2/c1-26-16-5-4-13(19)7-15(16)18(25)23-9-14(10-23)24-11-21-22-17(24)12-3-2-6-20-8-12/h2-8,11,14H,9-10H2,1H3

InChI Key

MZOGIUKQCCLJBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30459957

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.308

Distribution Coefficient, logD

1.300

Water Solubility, LogSw

-2.47

Polar Surface Area

58.418

Acid Dissociation Constant (pKa)

16.35

Base Dissociation Constant (pKb)

5.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

CM4297-7498 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with CM4297-7498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4297-7498?
Check Price and Availability of CM4297-7498, 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 CM4297-7498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4297-7498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4297-7498
  • 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 CM4297-7498 available by request