C156-0027 Screening compound: 5-bromo-N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)furan-2-carboxamide

C156-0027 Screening compound: 5-bromo-N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)furan-2-carboxamide
C156-0027 Screening compound: 5-bromo-N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C156-0027
5-bromo-N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)furan-2-carboxamide

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

C156-0027

Molecular Formula

C22H19BrN2O3S (C22 H19 BrN2 O3 S)

Compound Name

5-bromo-N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)furan-2-carboxamide

IUPAC name

5-bromo-N-(2-{[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl}ethyl)furan-2-carboxamide

SMILES

COc(cc1)ccc1-c([nH]c1c2cccc1)c2SCCNC(c(o1)ccc1Br)=O

InChI

InChI=1S/C22H19BrN2O3S/c1-27-15-8-6-14(7-9-15)20-21(16-4-2-3-5-17(16)25-20)29-13-12-24-22(26)18-10-11-19(23)28-18/h2-11,25H,12-13H2,1H3,(H,24,26)

InChI Key

MLLWSTUAWWCAPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03829162

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.514

Distribution Coefficient, logD

4.514

Water Solubility, LogSw

-4.28

Polar Surface Area

50.811

Acid Dissociation Constant (pKa)

12.02

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with C156-0027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C156-0027?
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What is the minimum amount of C156-0027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C156-0027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C156-0027
  • 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 C156-0027 available by request