F714-0366 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[2-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide

F714-0366 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[2-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide
F714-0366 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[2-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F714-0366
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[2-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide

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

F714-0366

Molecular Formula

C25H29FN2O3S (C25 H29 FN2 O3 S)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[2-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[2-(4-fluorobenzenesulfonyl)-1234-tetrahydroisoquinolin-1-yl]acetamide

SMILES

O=C(CC(c1c(CC2)cccc1)N2S(c(cc1)ccc1F)(=O)=O)NCCC1=CCCCC1

InChI

InChI=1S/C25H29FN2O3S/c26-21-10-12-22(13-11-21)32(30,31)28-17-15-20-8-4-5-9-23(20)24(28)18-25(29)27-16-14-19-6-2-1-3-7-19/h4-6,8-13,24H,1-3,7,14-18H2,(H,27,29)/t24-/m0/s1

InChI Key

BBUNHLGRGHDQIK-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD27642311

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.232

Distribution Coefficient, logD

4.232

Water Solubility, LogSw

-4.14

Polar Surface Area

56.158

Acid Dissociation Constant (pKa)

13.83

Base Dissociation Constant (pKb)

-1.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with F714-0366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F714-0366?
Check Price and Availability of F714-0366, 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 F714-0366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F714-0366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F714-0366
  • 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 F714-0366 available by request