T815-0952 Screening compound: 3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-isopropyl-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-propanone

T815-0952 Screening compound: 3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-isopropyl-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-propanone
T815-0952 Screening compound: 3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-isopropyl-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T815-0952
3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-isopropyl-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-propanone

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

T815-0952

Molecular Formula

C16H24N6O (C16 H24 N6 O)

Compound Name

3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-isopropyl-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-propanone

IUPAC name

n/a

SMILES

CC(C)c1nnc(C2)n1CCN2C(CCn1nc(C)cc1C)=O

InChI

InChI=1S/C16H24N6O/c1-11(2)16-18-17-14-10-20(7-8-21(14)16)15(23)5-6-22-13(4)9-12(3)19-22/h9,11H,5-8,10H2,1-4H3

InChI Key

MEQMSBXIOCLGSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027678

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.038

Distribution Coefficient, logD

0.038

Water Solubility, LogSw

-0.47

Polar Surface Area

55.051

Acid Dissociation Constant (pKa)

21.33

Base Dissociation Constant (pKb)

4.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

T815-0952 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

TLR-8 ligands Library (674 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Female
  • Skin
  • Immune system
Targets:
  • Others
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with T815-0952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T815-0952?
Check Price and Availability of T815-0952, 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 T815-0952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T815-0952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T815-0952
  • 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 T815-0952 available by request