CM4297-1023 Screening compound: 1-[3-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)azetidin-1-yl]-2-(4-fluorophenoxy)ethan-1-one

CM4297-1023 Screening compound: 1-[3-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)azetidin-1-yl]-2-(4-fluorophenoxy)ethan-1-one
CM4297-1023 Screening compound: 1-[3-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)azetidin-1-yl]-2-(4-fluorophenoxy)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4297-1023
1-[3-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)azetidin-1-yl]-2-(4-fluorophenoxy)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

CM4297-1023

Molecular Formula

C16H17FN4O2 (C16 H17 FN4 O2)

Compound Name

1-[3-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)azetidin-1-yl]-2-(4-fluorophenoxy)ethan-1-one

IUPAC name

1-[3-(3-cyclopropyl-4H-124-triazol-4-yl)azetidin-1-yl]-2-(4-fluorophenoxy)ethan-1-one

SMILES

O=C(COc(cc1)ccc1F)N(C1)CC1n1c(C2CC2)nnc1

InChI

InChI=1S/C16H17FN4O2/c17-12-3-5-14(6-4-12)23-9-15(22)20-7-13(8-20)21-10-18-19-16(21)11-1-2-11/h3-6,10-11,13H,1-2,7-9H2

InChI Key

WPBFYEJDZYZDPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30458413

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.985

Distribution Coefficient, logD

0.965

Water Solubility, LogSw

-1.52

Polar Surface Area

48.764

Acid Dissociation Constant (pKa)

19.34

Base Dissociation Constant (pKb)

6.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.75

CM4297-1023 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with CM4297-1023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4297-1023?
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What is the minimum amount of CM4297-1023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4297-1023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4297-1023
  • 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 CM4297-1023 available by request