E693-0068 Screening compound: 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(2-chlorophenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid

E693-0068 Screening compound: 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(2-chlorophenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid
E693-0068 Screening compound: 1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(2-chlorophenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound E693-0068
1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(2-chlorophenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid

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

E693-0068

Molecular Formula

C24H19Cl2FN2O2 (C24 H19 Cl2 FN2 O2)

Compound Name

1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(2-chlorophenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid

IUPAC name

1-[(2-chloro-4-fluorophenyl)methyl]-3-({[(2-chlorophenyl)methyl]amino}methyl)-1H-indole-2-carboxylic acid

SMILES

OC(c1c(CNCc(cccc2)c2Cl)c(cccc2)c2n1Cc(ccc(F)c1)c1Cl)=O

InChI

InChI=1S/C24H19Cl2FN2O2/c25-20-7-3-1-5-15(20)12-28-13-19-18-6-2-4-8-22(18)29(23(19)24(30)31)14-16-9-10-17(27)11-21(16)26/h1-11,28H,12-14H2,(H,30,31)

InChI Key

LZRZPQFVTNZDTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27601050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.805

Distribution Coefficient, logD

5.805

Water Solubility, LogSw

-5.67

Polar Surface Area

40.642

Acid Dissociation Constant (pKa)

4.47

Base Dissociation Constant (pKb)

10.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with E693-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E693-0068?
Check Price and Availability of E693-0068, 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 E693-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E693-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E693-0068
  • 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 E693-0068 available by request