7825-0810 Screening compound: N-(4-hydroxy-1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N'-phenylurea

7825-0810 Screening compound: N-(4-hydroxy-1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N'-phenylurea
7825-0810 Screening compound: N-(4-hydroxy-1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N'-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound 7825-0810
N-(4-hydroxy-1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N'-phenylurea

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

7825-0810

Molecular Formula

C11H14N2O4S (C11 H14 N2 O4 S)

Compound Name

N-(4-hydroxy-1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N'-phenylurea

IUPAC name

3-(4-hydroxy-11-dioxo-1lambda6-thiolan-3-yl)-1-phenylurea

SMILES

OC(CS(C1)(=O)=O)C1NC(Nc1ccccc1)=O

InChI

InChI=1S/C11H14N2O4S/c14-10-7-18(16,17)6-9(10)13-11(15)12-8-4-2-1-3-5-8/h1-5,9-10,14H,6-7H2,(H2,12,13,15)

InChI Key

OJCUILNGXCCKAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00434949

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-0.553

Distribution Coefficient, logD

-0.553

Water Solubility, LogSw

-1.89

Polar Surface Area

78.032

Acid Dissociation Constant (pKa)

14.26

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.40

7825-0810 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

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

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Soluble Diversity Library (15920 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 7825-0810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7825-0810?
Check Price and Availability of 7825-0810, 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 7825-0810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7825-0810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7825-0810
  • 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 7825-0810 available by request