8013-2162 Screening compound: N-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-4-ethoxybenzene-1-sulfonamide

8013-2162 Screening compound: N-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-4-ethoxybenzene-1-sulfonamide
8013-2162 Screening compound: N-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-4-ethoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-2162
N-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-4-ethoxybenzene-1-sulfonamide

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

8013-2162

Molecular Formula

C19H21BrN2O3S (C19 H21 BrN2 O3 S)

Compound Name

N-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-4-ethoxybenzene-1-sulfonamide

IUPAC name

N-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-4-ethoxybenzene-1-sulfonamide

SMILES

CCOc(cc1)ccc1S(NCCc1c(C)[nH]c(cc2)c1cc2Br)(=O)=O

InChI

InChI=1S/C19H21BrN2O3S/c1-3-25-15-5-7-16(8-6-15)26(23,24)21-11-10-17-13(2)22-19-9-4-14(20)12-18(17)19/h4-9,12,21-22H,3,10-11H2,1-2H3

InChI Key

KHNBDXRGDPLVRU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03763763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.836

Distribution Coefficient, logD

4.836

Water Solubility, LogSw

-4.64

Polar Surface Area

58.888

Acid Dissociation Constant (pKa)

12.01

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with 8013-2162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-2162?
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What is the minimum amount of 8013-2162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-2162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-2162
  • 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 8013-2162 available by request