E551-0340 Screening compound: methyl 2-({3-[2-(4-methoxybenzenesulfonamido)ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}sulfanyl)acetate

E551-0340 Screening compound: methyl 2-({3-[2-(4-methoxybenzenesulfonamido)ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}sulfanyl)acetate
E551-0340 Screening compound: methyl 2-({3-[2-(4-methoxybenzenesulfonamido)ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}sulfanyl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound E551-0340
methyl 2-({3-[2-(4-methoxybenzenesulfonamido)ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}sulfanyl)acetate

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

E551-0340

Molecular Formula

C17H19N5O5S2 (C17 H19 N5 O5 S2)

Compound Name

methyl 2-({3-[2-(4-methoxybenzenesulfonamido)ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}sulfanyl)acetate

IUPAC name

methyl 2-({3-[2-(4-methoxybenzenesulfonamido)ethyl]-[124]triazolo[43-b]pyridazin-6-yl}sulfanyl)acetate

SMILES

COC(CSc(cc1)nn2c1nnc2CCNS(c(cc1)ccc1OC)(=O)=O)=O

InChI

InChI=1S/C17H19N5O5S2/c1-26-12-3-5-13(6-4-12)29(24,25)18-10-9-15-20-19-14-7-8-16(21-22(14)15)28-11-17(23)27-2/h3-8,18H,9-11H2,1-2H3

InChI Key

DKFRVDDNPGPVGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05961562

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.5

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.197

Distribution Coefficient, logD

1.197

Water Solubility, LogSw

-2.40

Polar Surface Area

102.728

Acid Dissociation Constant (pKa)

10.81

Base Dissociation Constant (pKb)

1.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with E551-0340 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E551-0340?
Check Price and Availability of E551-0340, 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 E551-0340 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E551-0340
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E551-0340
  • 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 E551-0340 available by request