C105-3120 Screening compound: 3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylpropanamide

C105-3120 Screening compound: 3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylpropanamide
C105-3120 Screening compound: 3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C105-3120
3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylpropanamide

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

C105-3120

Molecular Formula

C15H13N3O3S2 (C15 H13 N3 O3 S2)

Compound Name

3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylpropanamide

IUPAC name

3-(213-benzothiadiazole-4-sulfonyl)-N-phenylpropanamide

SMILES

O=C(CCS(c1cccc2nsnc12)(=O)=O)Nc1ccccc1

InChI

InChI=1S/C15H13N3O3S2/c19-14(16-11-5-2-1-3-6-11)9-10-23(20,21)13-8-4-7-12-15(13)18-22-17-12/h1-8H,9-10H2,(H,16,19)

InChI Key

ZSASNWDYNTUAKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.270

Distribution Coefficient, logD

2.270

Water Solubility, LogSw

-2.74

Polar Surface Area

73.105

Acid Dissociation Constant (pKa)

11.77

Base Dissociation Constant (pKb)

-1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

C105-3120 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C105-3120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C105-3120?
Check Price and Availability of C105-3120, 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 C105-3120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C105-3120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C105-3120
  • 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 C105-3120 available by request