4032-1063 Screening compound: ethyl 4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-1H,4H,5H-indeno[1,2-b]pyridine-3-carboxylate

4032-1063 Screening compound: ethyl 4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-1H,4H,5H-indeno[1,2-b]pyridine-3-carboxylate
4032-1063 Screening compound: ethyl 4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-1H,4H,5H-indeno[1,2-b]pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4032-1063
ethyl 4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-1H,4H,5H-indeno[1,2-b]pyridine-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

4032-1063

Molecular Formula

C24H22BrNO4 (C24 H22 BrNO4)

Compound Name

ethyl 4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-1H,4H,5H-indeno[1,2-b]pyridine-3-carboxylate

IUPAC name

ethyl 4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-1H4H5H-indeno[12-b]pyridine-3-carboxylate

SMILES

CCOC(C(C1c(cc(cc2)Br)c2OCC)=C(C)NC(c2c3cccc2)=C1C3=O)=O

InChI

InChI=1S/C24H22BrNO4/c1-4-29-18-11-10-14(25)12-17(18)20-19(24(28)30-5-2)13(3)26-22-15-8-6-7-9-16(15)23(27)21(20)22/h6-12,20,26H,4-5H2,1-3H3/t20-/m0/s1

InChI Key

CTLWABSVANBABX-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD02929010

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.443

Distribution Coefficient, logD

1.429

Water Solubility, LogSw

-5.48

Polar Surface Area

52.036

Acid Dissociation Constant (pKa)

3.39

Base Dissociation Constant (pKb)

-6.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

4032-1063 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 4032-1063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4032-1063?
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What is the minimum amount of 4032-1063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4032-1063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4032-1063
  • 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 4032-1063 available by request