S259-2535 Screening compound: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-[(furan-2-yl)methyl]urea

S259-2535 Screening compound: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-[(furan-2-yl)methyl]urea
S259-2535 Screening compound: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-[(furan-2-yl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound S259-2535
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-[(furan-2-yl)methyl]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

S259-2535

Molecular Formula

C12H15N3O3 (C12 H15 N3 O3)

Compound Name

3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-[(furan-2-yl)methyl]urea

IUPAC name

3-[(35-dimethyl-12-oxazol-4-yl)methyl]-1-[(furan-2-yl)methyl]urea

SMILES

Cc1noc(C)c1CNC(NCc1ccco1)=O

InChI

InChI=1S/C12H15N3O3/c1-8-11(9(2)18-15-8)7-14-12(16)13-6-10-4-3-5-17-10/h3-5H,6-7H2,1-2H3,(H2,13,14,16)

InChI Key

GPMICLYSKVUEPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28042101

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

249.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.233

Distribution Coefficient, logD

1.233

Water Solubility, LogSw

-1.71

Polar Surface Area

64.973

Acid Dissociation Constant (pKa)

14.44

Base Dissociation Constant (pKb)

-0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

S259-2535 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with S259-2535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S259-2535?
Check Price and Availability of S259-2535, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S259-2535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S259-2535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S259-2535
  • 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 S259-2535 available by request