G827-0080 Screening compound: 3-(3,5-DIMETHYL-1-[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-6-YL-1H-PYRAZOL-4-YL)-N-(2-MORPHOLINOETHYL)PROPANAMIDE

G827-0080 Screening compound: 3-(3,5-DIMETHYL-1-[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-6-YL-1H-PYRAZOL-4-YL)-N-(2-MORPHOLINOETHYL)PROPANAMIDE
G827-0080 Screening compound: 3-(3,5-DIMETHYL-1-[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-6-YL-1H-PYRAZOL-4-YL)-N-(2-MORPHOLINOETHYL)PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G827-0080
3-(3,5-DIMETHYL-1-[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-6-YL-1H-PYRAZOL-4-YL)-N-(2-MORPHOLINOETHYL)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

G827-0080

Molecular Formula

C19H26N8O2 (C19 H26 N8 O2)

Compound Name

3-(3,5-DIMETHYL-1-[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-6-YL-1H-PYRAZOL-4-YL)-N-(2-MORPHOLINOETHYL)PROPANAMIDE

IUPAC name

3-(35-dimethyl-1-{[124]triazolo[43-b]pyridazin-6-yl}-1H-pyrazol-4-yl)-N-[2-(morpholin-4-yl)ethyl]propanamide

SMILES

Cc1c(CCC(NCCN2CCOCC2)=O)c(C)nn1-c(cc1)nn2c1nnc2

InChI

InChI=1S/C19H26N8O2/c1-14-16(3-6-19(28)20-7-8-25-9-11-29-12-10-25)15(2)27(23-14)18-5-4-17-22-21-13-26(17)24-18/h4-5,13H,3,6-12H2,1-2H3,(H,20,28)

InChI Key

NRHUAZDNZNIYHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27163600

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.674

Distribution Coefficient, logD

-0.750

Water Solubility, LogSw

-1.55

Polar Surface Area

83.134

Acid Dissociation Constant (pKa)

13.66

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.63

G827-0080 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G827-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G827-0080?
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What is the minimum amount of G827-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G827-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G827-0080
  • 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 G827-0080 available by request