P120-0918 Screening compound: 4-methyl-N-(6-methyl-2-oxo-1-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,2-dihydropyridin-3-yl)benzamide

P120-0918 Screening compound: 4-methyl-N-(6-methyl-2-oxo-1-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,2-dihydropyridin-3-yl)benzamide
P120-0918 Screening compound: 4-methyl-N-(6-methyl-2-oxo-1-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,2-dihydropyridin-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P120-0918
4-methyl-N-(6-methyl-2-oxo-1-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,2-dihydropyridin-3-yl)benzamide

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

P120-0918

Molecular Formula

C25H27N5O3 (C25 H27 N5 O3)

Compound Name

4-methyl-N-(6-methyl-2-oxo-1-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,2-dihydropyridin-3-yl)benzamide

IUPAC name

4-methyl-N-(6-methyl-2-oxo-1-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-12-dihydropyridin-3-yl)benzamide

SMILES

Cc(cc1)ccc1C(NC1=CC=C(C)N(CC(N(CC2)CCN2c2ncccc2)=O)C1=O)=O

InChI

InChI=1S/C25H27N5O3/c1-18-6-9-20(10-7-18)24(32)27-21-11-8-19(2)30(25(21)33)17-23(31)29-15-13-28(14-16-29)22-5-3-4-12-26-22/h3-12H,13-17H2,1-2H3,(H,27,32)

InChI Key

QEBXGDJKDSEMBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29019934

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.489

Distribution Coefficient, logD

2.302

Water Solubility, LogSw

-2.70

Polar Surface Area

67.646

Acid Dissociation Constant (pKa)

7.69

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

P120-0918 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P120-0918 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P120-0918?
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What is the minimum amount of P120-0918 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P120-0918
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P120-0918
  • 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 P120-0918 available by request