C361-0409 Screening compound: 2-methyl-N-[2-(4-methylphenyl)ethyl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide

C361-0409 Screening compound: 2-methyl-N-[2-(4-methylphenyl)ethyl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide
C361-0409 Screening compound: 2-methyl-N-[2-(4-methylphenyl)ethyl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C361-0409
2-methyl-N-[2-(4-methylphenyl)ethyl]-1-propanoyl-2,3-dihydro-1H-indole-5-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

C361-0409

Molecular Formula

C21H26N2O3S (C21 H26 N2 O3 S)

Compound Name

2-methyl-N-[2-(4-methylphenyl)ethyl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide

IUPAC name

2-methyl-N-[2-(4-methylphenyl)ethyl]-1-propanoyl-23-dihydro-1H-indole-5-sulfonamide

SMILES

CCC(N(C(C)C1)c(cc2)c1cc2S(NCCc1ccc(C)cc1)(=O)=O)=O

InChI

InChI=1S/C21H26N2O3S/c1-4-21(24)23-16(3)13-18-14-19(9-10-20(18)23)27(25,26)22-12-11-17-7-5-15(2)6-8-17/h5-10,14,16,22H,4,11-13H2,1-3H3/t16-/m1/s1

InChI Key

AZEWHOONRHOMCH-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD14752566

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.750

Distribution Coefficient, logD

3.750

Water Solubility, LogSw

-3.98

Polar Surface Area

56.200

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

-2.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

C361-0409 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C361-0409 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C361-0409?
Check Price and Availability of C361-0409, 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 C361-0409 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C361-0409
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C361-0409
  • 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 C361-0409 available by request