C105-0726 Screening compound: 3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(pyridin-2-yl)methyl]propanamide

C105-0726 Screening compound: 3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(pyridin-2-yl)methyl]propanamide
C105-0726 Screening compound: 3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(pyridin-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C105-0726
3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(pyridin-2-yl)methyl]propanamide

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

C105-0726

Molecular Formula

C15H14N4O3S2 (C15 H14 N4 O3 S2)

Compound Name

3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(pyridin-2-yl)methyl]propanamide

IUPAC name

3-(213-benzothiadiazole-4-sulfonyl)-N-[(pyridin-2-yl)methyl]propanamide

SMILES

O=C(CCS(c1cccc2nsnc12)(=O)=O)NCc1ncccc1

InChI

InChI=1S/C15H14N4O3S2/c20-14(17-10-11-4-1-2-8-16-11)7-9-24(21,22)13-6-3-5-12-15(13)19-23-18-12/h1-6,8H,7,9-10H2,(H,17,20)

InChI Key

DLLQDVKJHYCLJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719795

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.252

Distribution Coefficient, logD

1.252

Water Solubility, LogSw

-2.15

Polar Surface Area

83.970

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with C105-0726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C105-0726?
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What is the minimum amount of C105-0726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C105-0726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C105-0726
  • 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 C105-0726 available by request