F177-0223 Screening compound: ethyl 3-{[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]formamido}-3-(thiophen-2-yl)propanoate

F177-0223 Screening compound: ethyl 3-{[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]formamido}-3-(thiophen-2-yl)propanoate
F177-0223 Screening compound: ethyl 3-{[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]formamido}-3-(thiophen-2-yl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F177-0223
ethyl 3-{[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]formamido}-3-(thiophen-2-yl)propanoate

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

F177-0223

Molecular Formula

C24H21N3O4S (C24 H21 N3 O4 S)

Compound Name

ethyl 3-{[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenyl]formamido}-3-(thiophen-2-yl)propanoate

IUPAC name

ethyl 3-{[2-(3-phenyl-124-oxadiazol-5-yl)phenyl]formamido}-3-(thiophen-2-yl)propanoate

SMILES

CCOC(CC(c1cccs1)NC(c(cccc1)c1-c1nc(-c2ccccc2)no1)=O)=O

InChI

InChI=1S/C24H21N3O4S/c1-2-30-21(28)15-19(20-13-8-14-32-20)25-23(29)17-11-6-7-12-18(17)24-26-22(27-31-24)16-9-4-3-5-10-16/h3-14,19H,2,15H2,1H3,(H,25,29)/t19-/m0/s1

InChI Key

DSDIZDPQEPVBDL-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14944011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.827

Distribution Coefficient, logD

4.827

Water Solubility, LogSw

-4.57

Polar Surface Area

76.865

Acid Dissociation Constant (pKa)

12.90

Base Dissociation Constant (pKb)

-4.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

F177-0223 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F177-0223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F177-0223?
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What is the minimum amount of F177-0223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F177-0223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F177-0223
  • 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 F177-0223 available by request