4237-0502 Screening compound: ethyl 6-bromo-5-methoxy-1-phenyl-2-[(phenylamino)methyl]-1H-indole-3-carboxylate

4237-0502 Screening compound: ethyl 6-bromo-5-methoxy-1-phenyl-2-[(phenylamino)methyl]-1H-indole-3-carboxylate
4237-0502 Screening compound: ethyl 6-bromo-5-methoxy-1-phenyl-2-[(phenylamino)methyl]-1H-indole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4237-0502
ethyl 6-bromo-5-methoxy-1-phenyl-2-[(phenylamino)methyl]-1H-indole-3-carboxylate

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

4237-0502

Molecular Formula

C25H23BrN2O3 (C25 H23 BrN2 O3)

Compound Name

ethyl 6-bromo-5-methoxy-1-phenyl-2-[(phenylamino)methyl]-1H-indole-3-carboxylate

IUPAC name

ethyl 6-bromo-5-methoxy-1-phenyl-2-[(phenylamino)methyl]-1H-indole-3-carboxylate

SMILES

CCOC(c(c(c1c2)cc(OC)c2Br)c(CNc2ccccc2)n1-c1ccccc1)=O

InChI

InChI=1S/C25H23BrN2O3/c1-3-31-25(29)24-19-14-23(30-2)20(26)15-21(19)28(18-12-8-5-9-13-18)22(24)16-27-17-10-6-4-7-11-17/h4-15,27H,3,16H2,1-2H3

InChI Key

FOAPTWWCZCEKRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01579707

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.846

Distribution Coefficient, logD

5.846

Water Solubility, LogSw

-5.64

Polar Surface Area

40.311

Acid Dissociation Constant (pKa)

18.75

Base Dissociation Constant (pKb)

6.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

4237-0502 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4237-0502 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4237-0502?
Check Price and Availability of 4237-0502, 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 4237-0502 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4237-0502
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4237-0502
  • 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 4237-0502 available by request