C800-1087 Screening compound: 3-cyano-N,N-dimethyl-1H-indole-5-sulfonamide

C800-1087 Screening compound: 3-cyano-N,N-dimethyl-1H-indole-5-sulfonamide
C800-1087 Screening compound: 3-cyano-N,N-dimethyl-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C800-1087
3-cyano-N,N-dimethyl-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

C800-1087

Molecular Formula

C11H11N3O2S (C11 H11 N3 O2 S)

Compound Name

3-cyano-N,N-dimethyl-1H-indole-5-sulfonamide

IUPAC name

n/a

SMILES

CN(C)S(c(cc1)cc2c1[nH]cc2C#N)(=O)=O

InChI

InChI=1S/C11H11N3O2S/c1-14(2)17(15,16)9-3-4-11-10(5-9)8(6-12)7-13-11/h3-5,7,13H,1-2H3

InChI Key

OSCKTWXCPABUGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14799955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

249.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.515

Distribution Coefficient, logD

1.515

Water Solubility, LogSw

-2.49

Polar Surface Area

60.829

Acid Dissociation Constant (pKa)

14.31

Base Dissociation Constant (pKb)

-3.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

C800-1087 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C800-1087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C800-1087?
Check Price and Availability of C800-1087, 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 C800-1087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C800-1087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C800-1087
  • 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 C800-1087 available by request