6526-0545 Screening compound: ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(morpholin-4-yl)methyl]-1H-indole-3-carboxylate

6526-0545 Screening compound: ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(morpholin-4-yl)methyl]-1H-indole-3-carboxylate
6526-0545 Screening compound: ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(morpholin-4-yl)methyl]-1H-indole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6526-0545
ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(morpholin-4-yl)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

6526-0545

Molecular Formula

C20H28BrN3O4 (C20 H28 BrN3 O4)

Compound Name

ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(morpholin-4-yl)methyl]-1H-indole-3-carboxylate

IUPAC name

ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(morpholin-4-yl)methyl]-1H-indole-3-carboxylate

SMILES

CCOC(c(c1c2CN(C)C)c(CN3CCOCC3)n(C)c1cc(Br)c2O)=O

InChI

InChI=1S/C20H28BrN3O4/c1-5-28-20(26)18-16(12-24-6-8-27-9-7-24)23(4)15-10-14(21)19(25)13(17(15)18)11-22(2)3/h10,25H,5-9,11-12H2,1-4H3

InChI Key

AMRCHQSZZXWZBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01798681

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

454.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.095

Distribution Coefficient, logD

0.631

Water Solubility, LogSw

-2.12

Polar Surface Area

53.792

Acid Dissociation Constant (pKa)

9.39

Base Dissociation Constant (pKb)

8.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

6526-0545 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 6526-0545 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6526-0545?
Check Price and Availability of 6526-0545, 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 6526-0545 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6526-0545
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6526-0545
  • 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 6526-0545 available by request