M130-0078 Screening compound: 4-(4-methoxyphenyl)-6-{4-[4-(propan-2-yl)benzoyl]piperazin-1-yl}pyrimidine

M130-0078 Screening compound: 4-(4-methoxyphenyl)-6-{4-[4-(propan-2-yl)benzoyl]piperazin-1-yl}pyrimidine
M130-0078 Screening compound: 4-(4-methoxyphenyl)-6-{4-[4-(propan-2-yl)benzoyl]piperazin-1-yl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound M130-0078
4-(4-methoxyphenyl)-6-{4-[4-(propan-2-yl)benzoyl]piperazin-1-yl}pyrimidine

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

M130-0078

Molecular Formula

C25H28N4O2 (C25 H28 N4 O2)

Compound Name

4-(4-methoxyphenyl)-6-{4-[4-(propan-2-yl)benzoyl]piperazin-1-yl}pyrimidine

IUPAC name

4-(4-methoxyphenyl)-6-{4-[4-(propan-2-yl)benzoyl]piperazin-1-yl}pyrimidine

SMILES

CC(C)c(cc1)ccc1C(N(CC1)CCN1c1ncnc(-c(cc2)ccc2OC)c1)=O

InChI

InChI=1S/C25H28N4O2/c1-18(2)19-4-6-21(7-5-19)25(30)29-14-12-28(13-15-29)24-16-23(26-17-27-24)20-8-10-22(31-3)11-9-20/h4-11,16-18H,12-15H2,1-3H3

InChI Key

SQQANXBRMAZGMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27498518

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.52

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

5.325

Distribution Coefficient, logD

5.323

Water Solubility, LogSw

-5.46

Polar Surface Area

46.693

Acid Dissociation Constant (pKa)

23.23

Base Dissociation Constant (pKb)

4.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

M130-0078 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with M130-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M130-0078?
Check Price and Availability of M130-0078, 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 M130-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M130-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M130-0078
  • 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 M130-0078 available by request