F235-1441 Screening compound: ISOPROPYL 2-[(3-CYANO-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[B]PYRIDIN-2-YL)SULFANYL]ACETATE

F235-1441 Screening compound: ISOPROPYL 2-[(3-CYANO-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[B]PYRIDIN-2-YL)SULFANYL]ACETATE
F235-1441 Screening compound: ISOPROPYL 2-[(3-CYANO-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[B]PYRIDIN-2-YL)SULFANYL]ACETATE alternative view

Chemical Structure Depiction of ChemDiv screening compound F235-1441
ISOPROPYL 2-[(3-CYANO-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[B]PYRIDIN-2-YL)SULFANYL]ACETATE

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

F235-1441

Molecular Formula

C16H20N2O2S (C16 H20 N2 O2 S)

Compound Name

ISOPROPYL 2-[(3-CYANO-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[B]PYRIDIN-2-YL)SULFANYL]ACETATE

IUPAC name

n/a

SMILES

CC(C)OC(CSc1nc(CCCCC2)c2cc1C#N)=O

InChI

InChI=1S/C16H20N2O2S/c1-11(2)20-15(19)10-21-16-13(9-17)8-12-6-4-3-5-7-14(12)18-16/h8,11H,3-7,10H2,1-2H3

InChI Key

YMYAQPIAZPJYKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03234663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.894

Distribution Coefficient, logD

3.894

Water Solubility, LogSw

-3.74

Polar Surface Area

47.632

Acid Dissociation Constant (pKa)

21.73

Base Dissociation Constant (pKb)

1.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.00

F235-1441 in Drug Discovery

Included in Screening Libraries

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 F235-1441 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F235-1441?
Check Price and Availability of F235-1441, 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 F235-1441 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F235-1441
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F235-1441
  • 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 F235-1441 available by request