G827-0095 Screening compound: 3-(3,5-dimethyl-1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}-1H-pyrazol-4-yl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one

G827-0095 Screening compound: 3-(3,5-dimethyl-1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}-1H-pyrazol-4-yl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one
G827-0095 Screening compound: 3-(3,5-dimethyl-1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}-1H-pyrazol-4-yl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G827-0095
3-(3,5-dimethyl-1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}-1H-pyrazol-4-yl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one

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

G827-0095

Molecular Formula

C21H24N10O (C21 H24 N10 O)

Compound Name

3-(3,5-dimethyl-1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}-1H-pyrazol-4-yl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one

IUPAC name

3-(35-dimethyl-1-{[124]triazolo[43-b]pyridazin-6-yl}-1H-pyrazol-4-yl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one

SMILES

Cc1c(CCC(N(CC2)CCN2c2ncccn2)=O)c(C)nn1-c(cc1)nn2c1nnc2

InChI

InChI=1S/C21H24N10O/c1-15-17(16(2)31(26-15)19-6-5-18-25-24-14-30(18)27-19)4-7-20(32)28-10-12-29(13-11-28)21-22-8-3-9-23-21/h3,5-6,8-9,14H,4,7,10-13H2,1-2H3

InChI Key

AWMSRIKJYHJZNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27163611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.805

Distribution Coefficient, logD

0.805

Water Solubility, LogSw

-1.21

Polar Surface Area

84.945

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

G827-0095 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G827-0095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G827-0095?
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What is the minimum amount of G827-0095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G827-0095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G827-0095
  • 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 G827-0095 available by request