C614-6371 Screening compound: 5-methyl-3-[(5-methylthiophen-2-yl)(phenyl)methyl]-1H-indole

C614-6371 Screening compound: 5-methyl-3-[(5-methylthiophen-2-yl)(phenyl)methyl]-1H-indole
C614-6371 Screening compound: 5-methyl-3-[(5-methylthiophen-2-yl)(phenyl)methyl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-6371
5-methyl-3-[(5-methylthiophen-2-yl)(phenyl)methyl]-1H-indole

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

C614-6371

Molecular Formula

C21H19NS (C21 H19 NS)

Compound Name

5-methyl-3-[(5-methylthiophen-2-yl)(phenyl)methyl]-1H-indole

IUPAC name

5-methyl-3-[(5-methylthiophen-2-yl)(phenyl)methyl]-1H-indole

SMILES

Cc1ccc(C(c2c[nH]c3c2cc(C)cc3)c2ccccc2)s1

InChI

InChI=1S/C21H19NS/c1-14-8-10-19-17(12-14)18(13-22-19)21(16-6-4-3-5-7-16)20-11-9-15(2)23-20/h3-13,21-22H,1-2H3/t21-/m0/s1

InChI Key

ZMXJTASRUZARAO-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14776957

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.45

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

6.404

Distribution Coefficient, logD

6.404

Water Solubility, LogSw

-5.97

Polar Surface Area

10.584

Acid Dissociation Constant (pKa)

18.28

Base Dissociation Constant (pKb)

-3.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.30

C614-6371 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C614-6371 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-6371?
Check Price and Availability of C614-6371, 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 C614-6371 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-6371
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-6371
  • 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 C614-6371 available by request