G395-1693 Screening compound: ethyl 2-[3-(6-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate

G395-1693 Screening compound: ethyl 2-[3-(6-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate
G395-1693 Screening compound: ethyl 2-[3-(6-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G395-1693
ethyl 2-[3-(6-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate

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

G395-1693

Molecular Formula

C20H29N7O4 (C20 H29 N7 O4)

Compound Name

ethyl 2-[3-(6-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamido]propanoate

IUPAC name

ethyl 2-[3-(6-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}-[124]triazolo[43-b]pyridazin-3-yl)propanamido]propanoate

SMILES

CCOC(C(C)NC(CCc1nnc(cc2)n1nc2NCCCN(CCC1)C1=O)=O)=O

InChI

InChI=1S/C20H29N7O4/c1-3-31-20(30)14(2)22-18(28)10-9-17-24-23-16-8-7-15(25-27(16)17)21-11-5-13-26-12-4-6-19(26)29/h7-8,14H,3-6,9-13H2,1-2H3,(H,21,25)(H,22,28)/t14-/m0/s1

InChI Key

DUHZVYAQDXTOGZ-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD15008202

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-0.540

Distribution Coefficient, logD

-0.540

Water Solubility, LogSw

-1.74

Polar Surface Area

106.188

Acid Dissociation Constant (pKa)

13.77

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

G395-1693 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with G395-1693 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G395-1693?
Check Price and Availability of G395-1693, 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 G395-1693 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G395-1693
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G395-1693
  • 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 G395-1693 available by request