6623-0575 Screening compound: 3-[2-(1-benzyl-2-methyl-1H-indol-3-yl)ethyl]-1-(2-chlorobenzenesulfonyl)urea

6623-0575 Screening compound: 3-[2-(1-benzyl-2-methyl-1H-indol-3-yl)ethyl]-1-(2-chlorobenzenesulfonyl)urea
6623-0575 Screening compound: 3-[2-(1-benzyl-2-methyl-1H-indol-3-yl)ethyl]-1-(2-chlorobenzenesulfonyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 6623-0575
3-[2-(1-benzyl-2-methyl-1H-indol-3-yl)ethyl]-1-(2-chlorobenzenesulfonyl)urea

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

6623-0575

Molecular Formula

C25H24ClN3O3S (C25 H24 ClN3 O3 S)

Compound Name

3-[2-(1-benzyl-2-methyl-1H-indol-3-yl)ethyl]-1-(2-chlorobenzenesulfonyl)urea

IUPAC name

3-[2-(1-benzyl-2-methyl-1H-indol-3-yl)ethyl]-1-(2-chlorobenzenesulfonyl)urea

SMILES

Cc1c(CCNC(NS(c(cccc2)c2Cl)(=O)=O)=O)c(cccc2)c2n1Cc1ccccc1

InChI

InChI=1S/C25H24ClN3O3S/c1-18-20(15-16-27-25(30)28-33(31,32)24-14-8-6-12-22(24)26)21-11-5-7-13-23(21)29(18)17-19-9-3-2-4-10-19/h2-14H,15-17H2,1H3,(H2,27,28,30)

InChI Key

BZXDVEUWIKUHFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01872276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.660

Distribution Coefficient, logD

1.894

Water Solubility, LogSw

-4.69

Polar Surface Area

66.643

Acid Dissociation Constant (pKa)

4.63

Base Dissociation Constant (pKb)

-3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

6623-0575 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6623-0575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6623-0575?
Check Price and Availability of 6623-0575, 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 6623-0575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6623-0575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6623-0575
  • 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 6623-0575 available by request