6092-0006 Screening compound: ethyl N-phenyl-N-(2-thioxo-1,3,2lambda~5~-dioxaphospholan-2-yl)carbamate

6092-0006 Screening compound: ethyl N-phenyl-N-(2-thioxo-1,3,2lambda~5~-dioxaphospholan-2-yl)carbamate
6092-0006 Screening compound: ethyl N-phenyl-N-(2-thioxo-1,3,2lambda~5~-dioxaphospholan-2-yl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6092-0006
ethyl N-phenyl-N-(2-thioxo-1,3,2lambda~5~-dioxaphospholan-2-yl)carbamate

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

6092-0006

Molecular Formula

C11H14NO4PS (C11 H14 NO4 PS)

Compound Name

ethyl N-phenyl-N-(2-thioxo-1,3,2lambda~5~-dioxaphospholan-2-yl)carbamate

IUPAC name

ethyl N-phenyl-N-(2-sulfanylidene-132lambda5-dioxaphospholan-2-yl)carbamate

SMILES

CCOC(N(c1ccccc1)P1(OCCO1)=S)=O

InChI

InChI=1S/C11H14NO4PS/c1-2-14-11(13)12(10-6-4-3-5-7-10)17(18)15-8-9-16-17/h3-7H,2,8-9H2,1H3

InChI Key

YDUZYYRXLIRTGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02926595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

287.28

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.846

Distribution Coefficient, logD

2.846

Water Solubility, LogSw

-3.19

Polar Surface Area

37.925

Acid Dissociation Constant (pKa)

28.24

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

6092-0006 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6092-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6092-0006?
Check Price and Availability of 6092-0006, 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 6092-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6092-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6092-0006
  • 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 6092-0006 available by request