3405-0208 Screening compound: 2-ethoxy-4-(morpholine-4-carbothioyl)phenol

3405-0208 Screening compound: 2-ethoxy-4-(morpholine-4-carbothioyl)phenol
3405-0208 Screening compound: 2-ethoxy-4-(morpholine-4-carbothioyl)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3405-0208
2-ethoxy-4-(morpholine-4-carbothioyl)phenol

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

3405-0208

Molecular Formula

C13H17NO3S (C13 H17 NO3 S)

Compound Name

2-ethoxy-4-(morpholine-4-carbothioyl)phenol

IUPAC name

2-ethoxy-4-(morpholine-4-carbothioyl)phenol

SMILES

CCOc(cc(cc1)C(N2CCOCC2)=S)c1O

InChI

InChI=1S/C13H17NO3S/c1-2-17-12-9-10(3-4-11(12)15)13(18)14-5-7-16-8-6-14/h3-4,9,15H,2,5-8H2,1H3

InChI Key

DGNXUZXQVCKITP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00754251

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.967

Distribution Coefficient, logD

1.966

Water Solubility, LogSw

-2.21

Polar Surface Area

33.854

Acid Dissociation Constant (pKa)

10.84

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

3405-0208 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3405-0208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3405-0208?
Check Price and Availability of 3405-0208, 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 3405-0208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3405-0208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3405-0208
  • 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 3405-0208 available by request