F256-1786 Screening compound: 3-(2-{5-[(3,4-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-3-methyl-1-(3-methylphenyl)urea

F256-1786 Screening compound: 3-(2-{5-[(3,4-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-3-methyl-1-(3-methylphenyl)urea
F256-1786 Screening compound: 3-(2-{5-[(3,4-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-3-methyl-1-(3-methylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound F256-1786
3-(2-{5-[(3,4-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-3-methyl-1-(3-methylphenyl)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

F256-1786

Molecular Formula

C22H26N4O3 (C22 H26 N4 O3)

Compound Name

3-(2-{5-[(3,4-dimethylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}ethyl)-3-methyl-1-(3-methylphenyl)urea

IUPAC name

3-(2-{5-[(34-dimethylphenoxy)methyl]-124-oxadiazol-3-yl}ethyl)-3-methyl-1-(3-methylphenyl)urea

SMILES

Cc1cccc(NC(N(C)CCc2noc(COc3cc(C)c(C)cc3)n2)=O)c1

InChI

InChI=1S/C22H26N4O3/c1-15-6-5-7-18(12-15)23-22(27)26(4)11-10-20-24-21(29-25-20)14-28-19-9-8-16(2)17(3)13-19/h5-9,12-13H,10-11,14H2,1-4H3,(H,23,27)

InChI Key

QCYXYWIHNIVCCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27110200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.620

Distribution Coefficient, logD

4.620

Water Solubility, LogSw

-4.29

Polar Surface Area

65.021

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

-0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

F256-1786 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 F256-1786 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F256-1786?
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What is the minimum amount of F256-1786 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F256-1786
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F256-1786
  • 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 F256-1786 available by request