G395-1055 Screening compound: N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(6-{[(pyridin-3-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

G395-1055 Screening compound: N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(6-{[(pyridin-3-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
G395-1055 Screening compound: N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(6-{[(pyridin-3-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G395-1055
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(6-{[(pyridin-3-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)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

G395-1055

Molecular Formula

C23H25N7OS (C23 H25 N7 OS)

Compound Name

N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(6-{[(pyridin-3-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

IUPAC name

N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(6-{[(pyridin-3-yl)methyl]amino}-[124]triazolo[43-b]pyridazin-3-yl)propanamide

SMILES

CSc1ccc(CCNC(CCc2nnc(cc3)n2nc3NCc2cnccc2)=O)cc1

InChI

InChI=1S/C23H25N7OS/c1-32-19-6-4-17(5-7-19)12-14-25-23(31)11-10-22-28-27-21-9-8-20(29-30(21)22)26-16-18-3-2-13-24-15-18/h2-9,13,15H,10-12,14,16H2,1H3,(H,25,31)(H,26,29)

InChI Key

JFNWWCOSBXGSDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15007862

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.402

Distribution Coefficient, logD

1.372

Water Solubility, LogSw

-1.73

Polar Surface Area

78.006

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

6.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with G395-1055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G395-1055?
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What is the minimum amount of G395-1055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G395-1055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G395-1055
  • 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 G395-1055 available by request