M460-4076 Screening compound: N-(4-methoxyphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrazin-2-yl}acetamide

M460-4076 Screening compound: N-(4-methoxyphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrazin-2-yl}acetamide
M460-4076 Screening compound: N-(4-methoxyphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrazin-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M460-4076
N-(4-methoxyphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrazin-2-yl}acetamide

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

M460-4076

Molecular Formula

C25H27N7O3 (C25 H27 N7 O3)

Compound Name

N-(4-methoxyphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrazin-2-yl}acetamide

IUPAC name

N-(4-methoxyphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H3H-[124]triazolo[43-a]pyrazin-2-yl}acetamide

SMILES

Cc(cc1)ccc1N(CC1)CCN1C(C1=NN2CC(Nc(cc3)ccc3OC)=O)=NC=CN1C2=O

InChI

InChI=1S/C25H27N7O3/c1-18-3-7-20(8-4-18)29-13-15-30(16-14-29)23-24-28-32(25(34)31(24)12-11-26-23)17-22(33)27-19-5-9-21(35-2)10-6-19/h3-12H,13-17H2,1-2H3,(H,27,33)

InChI Key

KDJJLQJJBCVATQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27542945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.817

Distribution Coefficient, logD

2.817

Water Solubility, LogSw

-3.27

Polar Surface Area

76.013

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with M460-4076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M460-4076?
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What is the minimum amount of M460-4076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M460-4076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M460-4076
  • 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 M460-4076 available by request