4353-0015 Screening compound: ethyl 2-[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate

4353-0015 Screening compound: ethyl 2-[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate
4353-0015 Screening compound: ethyl 2-[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4353-0015
ethyl 2-[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate

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

4353-0015

Molecular Formula

C14H17NO2S (C14 H17 NO2 S)

Compound Name

ethyl 2-[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate

IUPAC name

ethyl 2-[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate

SMILES

CCOC(Cc(n(C)c1c2cccc1)c2SC)=O

InChI

InChI=1S/C14H17NO2S/c1-4-17-13(16)9-12-14(18-3)10-7-5-6-8-11(10)15(12)2/h5-8H,4,9H2,1-3H3

InChI Key

YQRSRAUOGSMWMP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00438768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

263.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.815

Distribution Coefficient, logD

2.815

Water Solubility, LogSw

-2.92

Polar Surface Area

22.190

Acid Dissociation Constant (pKa)

20.46

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

4353-0015 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4353-0015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4353-0015?
Check Price and Availability of 4353-0015, 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 4353-0015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4353-0015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4353-0015
  • 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 4353-0015 available by request