L084-1947 Screening compound: 3-chloro-4-fluoro-N-methyl-N-(2-{5-[4-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)benzamide

L084-1947 Screening compound: 3-chloro-4-fluoro-N-methyl-N-(2-{5-[4-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)benzamide
L084-1947 Screening compound: 3-chloro-4-fluoro-N-methyl-N-(2-{5-[4-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L084-1947
3-chloro-4-fluoro-N-methyl-N-(2-{5-[4-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)benzamide

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

L084-1947

Molecular Formula

C23H22ClFN4O4 (C23 H22 ClFN4 O4)

Compound Name

3-chloro-4-fluoro-N-methyl-N-(2-{5-[4-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)benzamide

IUPAC name

3-chloro-4-fluoro-N-methyl-N-(2-{5-[4-(morpholine-4-carbonyl)phenyl]-124-oxadiazol-3-yl}ethyl)benzamide

SMILES

CN(CCc1noc(-c(cc2)ccc2C(N2CCOCC2)=O)n1)C(c(cc1)cc(Cl)c1F)=O

InChI

InChI=1S/C23H22ClFN4O4/c1-28(22(30)17-6-7-19(25)18(24)14-17)9-8-20-26-21(33-27-20)15-2-4-16(5-3-15)23(31)29-10-12-32-13-11-29/h2-7,14H,8-13H2,1H3

InChI Key

ONZCZPHNQXGWBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27229826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.9

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.173

Distribution Coefficient, logD

2.173

Water Solubility, LogSw

-3.25

Polar Surface Area

73.592

Acid Dissociation Constant (pKa)

28.36

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

L084-1947 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L084-1947 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L084-1947?
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What is the minimum amount of L084-1947 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L084-1947
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L084-1947
  • 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 L084-1947 available by request