C800-0312 Screening compound: 1-methyl-2-(thiophen-2-yl)-1H-indole-3-carbaldehyde

C800-0312 Screening compound: 1-methyl-2-(thiophen-2-yl)-1H-indole-3-carbaldehyde
C800-0312 Screening compound: 1-methyl-2-(thiophen-2-yl)-1H-indole-3-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound C800-0312
1-methyl-2-(thiophen-2-yl)-1H-indole-3-carbaldehyde

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

C800-0312

Molecular Formula

C14H11NOS (C14 H11 NOS)

Compound Name

1-methyl-2-(thiophen-2-yl)-1H-indole-3-carbaldehyde

IUPAC name

1-methyl-2-(thiophen-2-yl)-1H-indole-3-carbaldehyde

SMILES

Cn1c(-c2cccs2)c(C=O)c2c1cccc2

InChI

InChI=1S/C14H11NOS/c1-15-12-6-3-2-5-10(12)11(9-16)14(15)13-7-4-8-17-13/h2-9H,1H3

InChI Key

DVWRWALXJAGLPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14280802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

241.31

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.294

Distribution Coefficient, logD

3.294

Water Solubility, LogSw

-3.39

Polar Surface Area

16.456

Acid Dissociation Constant (pKa)

30.62

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

C800-0312 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with C800-0312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C800-0312?
Check Price and Availability of C800-0312, 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 C800-0312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C800-0312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C800-0312
  • 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 C800-0312 available by request