K786-3442F Screening compound: N~1~-(2-chloro-4-fluorobenzyl)-4-(1-methyl-1H-indol-3-yl)butanamide

K786-3442F Screening compound: N~1~-(2-chloro-4-fluorobenzyl)-4-(1-methyl-1H-indol-3-yl)butanamide
K786-3442F Screening compound: N~1~-(2-chloro-4-fluorobenzyl)-4-(1-methyl-1H-indol-3-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-3442F
N~1~-(2-chloro-4-fluorobenzyl)-4-(1-methyl-1H-indol-3-yl)butanamide

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

K786-3442F

Molecular Formula

C20H20ClFN2O (C20 H20 ClFN2 O)

Compound Name

N~1~-(2-chloro-4-fluorobenzyl)-4-(1-methyl-1H-indol-3-yl)butanamide

IUPAC name

N-[(2-chloro-4-fluorophenyl)methyl]-4-(1-methyl-1H-indol-3-yl)butanamide

SMILES

Cn1c(cccc2)c2c(CCCC(NCc(ccc(F)c2)c2Cl)=O)c1

InChI

InChI=1S/C20H20ClFN2O/c1-24-13-15(17-6-2-3-7-19(17)24)5-4-8-20(25)23-12-14-9-10-16(22)11-18(14)21/h2-3,6-7,9-11,13H,4-5,8,12H2,1H3,(H,23,25)

InChI Key

FBYJDXKDAIKMLW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.84

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.388

Distribution Coefficient, logD

4.388

Water Solubility, LogSw

-4.45

Polar Surface Area

26.998

Acid Dissociation Constant (pKa)

11.64

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with K786-3442F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-3442F?
Check Price and Availability of K786-3442F, 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 K786-3442F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-3442F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-3442F
  • 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 K786-3442F available by request