M460-4057 Screening compound: N-(3-methylphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrazin-2-yl}acetamide

M460-4057 Screening compound: N-(3-methylphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyrazin-2-yl}acetamide
M460-4057 Screening compound: N-(3-methylphenyl)-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 M460-4057
N-(3-methylphenyl)-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

M460-4057

Molecular Formula

C25H27N7O2 (C25 H27 N7 O2)

Compound Name

N-(3-methylphenyl)-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-(3-methylphenyl)-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(Nc3cc(C)ccc3)=O)=NC=CN1C2=O

InChI

InChI=1S/C25H27N7O2/c1-18-6-8-21(9-7-18)29-12-14-30(15-13-29)23-24-28-32(25(34)31(24)11-10-26-23)17-22(33)27-20-5-3-4-19(2)16-20/h3-11,16H,12-15,17H2,1-2H3,(H,27,33)

InChI Key

KBSLJUNSGKMECV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27542930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.194

Distribution Coefficient, logD

3.194

Water Solubility, LogSw

-3.14

Polar Surface Area

68.469

Acid Dissociation Constant (pKa)

13.52

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 M460-4057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M460-4057?
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What is the minimum amount of M460-4057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M460-4057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M460-4057
  • 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 M460-4057 available by request