K893-0990 Screening compound: N-[3-(azepan-1-yl)propyl]-2,1,3-benzothiadiazole-4-sulfonamide

K893-0990 Screening compound: N-[3-(azepan-1-yl)propyl]-2,1,3-benzothiadiazole-4-sulfonamide
K893-0990 Screening compound: N-[3-(azepan-1-yl)propyl]-2,1,3-benzothiadiazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K893-0990
N-[3-(azepan-1-yl)propyl]-2,1,3-benzothiadiazole-4-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

K893-0990

Molecular Formula

C15H22N4O2S2 (C15 H22 N4 O2 S2)

Compound Name

N-[3-(azepan-1-yl)propyl]-2,1,3-benzothiadiazole-4-sulfonamide

IUPAC name

N-[3-(azepan-1-yl)propyl]-213-benzothiadiazole-4-sulfonamide

SMILES

O=S(c1cccc2nsnc12)(NCCCN1CCCCCC1)=O

InChI

InChI=1S/C15H22N4O2S2/c20-23(21,14-8-5-7-13-15(14)18-22-17-13)16-9-6-12-19-10-3-1-2-4-11-19/h5,7-8,16H,1-4,6,9-12H2

InChI Key

JADKOGDDZJIDNG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05026356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.5

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

2.647

Distribution Coefficient, logD

0.488

Water Solubility, LogSw

-2.93

Polar Surface Area

67.104

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

9.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with K893-0990 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K893-0990?
Check Price and Availability of K893-0990, 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 K893-0990 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K893-0990
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K893-0990
  • 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 K893-0990 available by request