L491-0620 Screening compound: ethyl 4-({[2-(4-ethylphenyl)-1H-indol-3-yl]carbamoyl}amino)benzoate

L491-0620 Screening compound: ethyl 4-({[2-(4-ethylphenyl)-1H-indol-3-yl]carbamoyl}amino)benzoate
L491-0620 Screening compound: ethyl 4-({[2-(4-ethylphenyl)-1H-indol-3-yl]carbamoyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L491-0620
ethyl 4-({[2-(4-ethylphenyl)-1H-indol-3-yl]carbamoyl}amino)benzoate

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

L491-0620

Molecular Formula

C26H25N3O3 (C26 H25 N3 O3)

Compound Name

ethyl 4-({[2-(4-ethylphenyl)-1H-indol-3-yl]carbamoyl}amino)benzoate

IUPAC name

ethyl 4-({[2-(4-ethylphenyl)-1H-indol-3-yl]carbamoyl}amino)benzoate

SMILES

CCc(cc1)ccc1-c([nH]c1c2cccc1)c2NC(Nc(cc1)ccc1C(OCC)=O)=O

InChI

InChI=1S/C26H25N3O3/c1-3-17-9-11-18(12-10-17)23-24(21-7-5-6-8-22(21)28-23)29-26(31)27-20-15-13-19(14-16-20)25(30)32-4-2/h5-16,28H,3-4H2,1-2H3,(H2,27,29,31)

InChI Key

NZBRMLNAEVWRJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27457988

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.378

Distribution Coefficient, logD

6.378

Water Solubility, LogSw

-5.95

Polar Surface Area

61.747

Acid Dissociation Constant (pKa)

12.52

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

L491-0620 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Indole Derivatives (10091 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Structure:
  • Cyclic compounds
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L491-0620 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L491-0620?
Check Price and Availability of L491-0620, 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 L491-0620 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L491-0620
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L491-0620
  • 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 L491-0620 available by request