M130-1064 Screening compound: (2E)-3-(2-methoxyphenyl)-1-{4-[6-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}prop-2-en-1-one

M130-1064 Screening compound: (2E)-3-(2-methoxyphenyl)-1-{4-[6-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}prop-2-en-1-one
M130-1064 Screening compound: (2E)-3-(2-methoxyphenyl)-1-{4-[6-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}prop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M130-1064
(2E)-3-(2-methoxyphenyl)-1-{4-[6-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}prop-2-en-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

M130-1064

Molecular Formula

C25H26N4O2 (C25 H26 N4 O2)

Compound Name

(2E)-3-(2-methoxyphenyl)-1-{4-[6-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}prop-2-en-1-one

IUPAC name

(2E)-3-(2-methoxyphenyl)-1-{4-[6-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}prop-2-en-1-one

SMILES

Cc(cc1)ccc1-c1cc(N(CC2)CCN2C(/C=C/c(cccc2)c2OC)=O)ncn1

InChI

InChI=1S/C25H26N4O2/c1-19-7-9-20(10-8-19)22-17-24(27-18-26-22)28-13-15-29(16-14-28)25(30)12-11-21-5-3-4-6-23(21)31-2/h3-12,17-18H,13-16H2,1-2H3

InChI Key

VBFWYXMPIYJVDL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15141117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.240

Distribution Coefficient, logD

5.226

Water Solubility, LogSw

-5.06

Polar Surface Area

46.252

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

5.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

M130-1064 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with M130-1064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M130-1064?
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What is the minimum amount of M130-1064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M130-1064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M130-1064
  • 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 M130-1064 available by request