F256-0057 Screening compound: 3-[2-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)ethyl]-3-methyl-1-[3-(trifluoromethyl)phenyl]urea

F256-0057 Screening compound: 3-[2-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)ethyl]-3-methyl-1-[3-(trifluoromethyl)phenyl]urea
F256-0057 Screening compound: 3-[2-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)ethyl]-3-methyl-1-[3-(trifluoromethyl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound F256-0057
3-[2-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)ethyl]-3-methyl-1-[3-(trifluoromethyl)phenyl]urea

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

F256-0057

Molecular Formula

C19H23F3N4O2 (C19 H23 F3 N4 O2)

Compound Name

3-[2-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)ethyl]-3-methyl-1-[3-(trifluoromethyl)phenyl]urea

IUPAC name

3-[2-(5-cyclohexyl-124-oxadiazol-3-yl)ethyl]-3-methyl-1-[3-(trifluoromethyl)phenyl]urea

SMILES

CN(CCc1noc(C2CCCCC2)n1)C(Nc1cccc(C(F)(F)F)c1)=O

InChI

InChI=1S/C19H23F3N4O2/c1-26(18(27)23-15-9-5-8-14(12-15)19(20,21)22)11-10-16-24-17(28-25-16)13-6-3-2-4-7-13/h5,8-9,12-13H,2-4,6-7,10-11H2,1H3,(H,23,27)

InChI Key

SJCZZIRAHPWIMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27109790

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.017

Distribution Coefficient, logD

5.017

Water Solubility, LogSw

-4.62

Polar Surface Area

58.048

Acid Dissociation Constant (pKa)

11.08

Base Dissociation Constant (pKb)

-0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

F256-0057 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 F256-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F256-0057?
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What is the minimum amount of F256-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F256-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F256-0057
  • 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 F256-0057 available by request