F257-1841 Screening compound: 2-cyclopentyl-N-(2-{5-[(3,5-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-N-methylacetamide

F257-1841 Screening compound: 2-cyclopentyl-N-(2-{5-[(3,5-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-N-methylacetamide
F257-1841 Screening compound: 2-cyclopentyl-N-(2-{5-[(3,5-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F257-1841
2-cyclopentyl-N-(2-{5-[(3,5-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-N-methylacetamide

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

F257-1841

Molecular Formula

C21H29N3O3 (C21 H29 N3 O3)

Compound Name

2-cyclopentyl-N-(2-{5-[(3,5-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-N-methylacetamide

IUPAC name

2-cyclopentyl-N-(2-{5-[(35-dimethylphenoxy)methyl]-124-oxadiazol-3-yl}ethyl)-N-methylacetamide

SMILES

Cc1cc(OCc2nc(CCN(C)C(CC3CCCC3)=O)no2)cc(C)c1

InChI

InChI=1S/C21H29N3O3/c1-15-10-16(2)12-18(11-15)26-14-20-22-19(23-27-20)8-9-24(3)21(25)13-17-6-4-5-7-17/h10-12,17H,4-9,13-14H2,1-3H3

InChI Key

MODOMAPTDBLHGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27110520

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.139

Distribution Coefficient, logD

4.139

Water Solubility, LogSw

-4.17

Polar Surface Area

56.231

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

F257-1841 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 F257-1841 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F257-1841?
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What is the minimum amount of F257-1841 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F257-1841
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F257-1841
  • 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 F257-1841 available by request