C760-0365 Screening compound: ETHYL 4-(4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-AMIDO)BENZOATE

C760-0365 Screening compound: ETHYL 4-(4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-AMIDO)BENZOATE
C760-0365 Screening compound: ETHYL 4-(4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-AMIDO)BENZOATE alternative view

Chemical Structure Depiction of ChemDiv screening compound C760-0365
ETHYL 4-(4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-AMIDO)BENZOATE

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

C760-0365

Molecular Formula

C18H19NO3S (C18 H19 NO3 S)

Compound Name

ETHYL 4-(4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-AMIDO)BENZOATE

IUPAC name

n/a

SMILES

CCOC(c(cc1)ccc1NC(c1csc2c1CCCC2)=O)=O

InChI

InChI=1S/C18H19NO3S/c1-2-22-18(21)12-7-9-13(10-8-12)19-17(20)15-11-23-16-6-4-3-5-14(15)16/h7-11H,2-6H2,1H3,(H,19,20)

InChI Key

CCTSFIUDZXWNPO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03721355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.631

Distribution Coefficient, logD

4.630

Water Solubility, LogSw

-4.35

Polar Surface Area

45.022

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

-3.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.00

C760-0365 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Protein-Protein Interaction Library (218420 compounds)

SH2 Library (10483 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Cancer
  • Endocrine
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with C760-0365 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C760-0365?
Check Price and Availability of C760-0365, 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 C760-0365 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C760-0365
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C760-0365
  • 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 C760-0365 available by request