G395-0077 Screening compound: 3-[6-(diethylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3-fluoro-4-methylphenyl)propanamide

G395-0077 Screening compound: 3-[6-(diethylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3-fluoro-4-methylphenyl)propanamide
G395-0077 Screening compound: 3-[6-(diethylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3-fluoro-4-methylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G395-0077
3-[6-(diethylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3-fluoro-4-methylphenyl)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

G395-0077

Molecular Formula

C19H23FN6O (C19 H23 FN6 O)

Compound Name

3-[6-(diethylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3-fluoro-4-methylphenyl)propanamide

IUPAC name

3-[6-(diethylamino)-[124]triazolo[43-b]pyridazin-3-yl]-N-(3-fluoro-4-methylphenyl)propanamide

SMILES

CCN(CC)c(cc1)nn2c1nnc2CCC(Nc1cc(F)c(C)cc1)=O

InChI

InChI=1S/C19H23FN6O/c1-4-25(5-2)18-9-8-16-22-23-17(26(16)24-18)10-11-19(27)21-14-7-6-13(3)15(20)12-14/h6-9,12H,4-5,10-11H2,1-3H3,(H,21,27)

InChI Key

RNIQFGCBRZFANB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15007541

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.816

Distribution Coefficient, logD

2.816

Water Solubility, LogSw

-3.13

Polar Surface Area

58.722

Acid Dissociation Constant (pKa)

10.52

Base Dissociation Constant (pKb)

2.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

G395-0077 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G395-0077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G395-0077?
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What is the minimum amount of G395-0077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G395-0077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G395-0077
  • 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 G395-0077 available by request