J003-0005 Screening compound: N~1~-(4-chlorophenyl)-2-methyl-5-[1,2,4]triazolo[4,3-b]pyridazin-6-yl-1-benzenesulfonamide

J003-0005 Screening compound: N~1~-(4-chlorophenyl)-2-methyl-5-[1,2,4]triazolo[4,3-b]pyridazin-6-yl-1-benzenesulfonamide
J003-0005 Screening compound: N~1~-(4-chlorophenyl)-2-methyl-5-[1,2,4]triazolo[4,3-b]pyridazin-6-yl-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J003-0005
N~1~-(4-chlorophenyl)-2-methyl-5-[1,2,4]triazolo[4,3-b]pyridazin-6-yl-1-benzenesulfonamide

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

J003-0005

Molecular Formula

C18H14ClN5O2S (C18 H14 ClN5 O2 S)

Compound Name

N~1~-(4-chlorophenyl)-2-methyl-5-[1,2,4]triazolo[4,3-b]pyridazin-6-yl-1-benzenesulfonamide

IUPAC name

n/a

SMILES

Cc(ccc(-c(cc1)nn2c1nnc2)c1)c1S(Nc(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C18H14ClN5O2S/c1-12-2-3-13(16-8-9-18-21-20-11-24(18)22-16)10-17(12)27(25,26)23-15-6-4-14(19)5-7-15/h2-11,23H,1H3

InChI Key

FOELHODTQQHRSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27214826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.86

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.546

Distribution Coefficient, logD

2.243

Water Solubility, LogSw

-4.05

Polar Surface Area

73.698

Acid Dissociation Constant (pKa)

6.12

Base Dissociation Constant (pKb)

1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

References: we are preparing a list of scientific research reports with J003-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J003-0005?
Check Price and Availability of J003-0005, 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 J003-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J003-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J003-0005
  • 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 J003-0005 available by request