E155-1066 Screening compound: 2-chloro-N~1~-[2-[3,4-dihydro-2(1H)-isoquinolinyl]-2-(3-pyridyl)ethyl]-6-fluorobenzamide

E155-1066 Screening compound: 2-chloro-N~1~-[2-[3,4-dihydro-2(1H)-isoquinolinyl]-2-(3-pyridyl)ethyl]-6-fluorobenzamide
E155-1066 Screening compound: 2-chloro-N~1~-[2-[3,4-dihydro-2(1H)-isoquinolinyl]-2-(3-pyridyl)ethyl]-6-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E155-1066
2-chloro-N~1~-[2-[3,4-dihydro-2(1H)-isoquinolinyl]-2-(3-pyridyl)ethyl]-6-fluorobenzamide

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

E155-1066

Molecular Formula

C23H21ClFN3O (C23 H21 ClFN3 O)

Compound Name

2-chloro-N~1~-[2-[3,4-dihydro-2(1H)-isoquinolinyl]-2-(3-pyridyl)ethyl]-6-fluorobenzamide

IUPAC name

n/a

SMILES

O=C(c(c(F)ccc1)c1Cl)NCC(c1cnccc1)N(CC1)Cc2c1cccc2

InChI

InChI=1S/C23H21ClFN3O/c24-19-8-3-9-20(25)22(19)23(29)27-14-21(17-7-4-11-26-13-17)28-12-10-16-5-1-2-6-18(16)15-28/h1-9,11,13,21H,10,12,14-15H2,(H,27,29)/t21-/m0/s1

InChI Key

MOGILUHEPXBPPC-NRFANRHFSA-N

MDL Number (MFCD)

MFCD07716683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.555

Distribution Coefficient, logD

3.552

Water Solubility, LogSw

-4.34

Polar Surface Area

36.821

Acid Dissociation Constant (pKa)

10.00

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with E155-1066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E155-1066?
Check Price and Availability of E155-1066, 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 E155-1066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E155-1066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E155-1066
  • 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 E155-1066 available by request