G876-0745 Screening compound: N-[(2-chlorophenyl)methyl]-2-(2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methoxy-4-oxo-1,4-dihydropyridin-1-yl)acetamide

G876-0745 Screening compound: N-[(2-chlorophenyl)methyl]-2-(2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methoxy-4-oxo-1,4-dihydropyridin-1-yl)acetamide
G876-0745 Screening compound: N-[(2-chlorophenyl)methyl]-2-(2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methoxy-4-oxo-1,4-dihydropyridin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G876-0745
N-[(2-chlorophenyl)methyl]-2-(2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methoxy-4-oxo-1,4-dihydropyridin-1-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

G876-0745

Molecular Formula

C26H28ClFN4O3 (C26 H28 ClFN4 O3)

Compound Name

N-[(2-chlorophenyl)methyl]-2-(2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methoxy-4-oxo-1,4-dihydropyridin-1-yl)acetamide

IUPAC name

N-[(2-chlorophenyl)methyl]-2-(2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methoxy-4-oxo-14-dihydropyridin-1-yl)acetamide

SMILES

COC1=CN(CC(NCc(cccc2)c2Cl)=O)C(CN(CC2)CCN2c(cc2)ccc2F)=CC1=O

InChI

InChI=1S/C26H28ClFN4O3/c1-35-25-17-32(18-26(34)29-15-19-4-2-3-5-23(19)27)22(14-24(25)33)16-30-10-12-31(13-11-30)21-8-6-20(28)7-9-21/h2-9,14,17H,10-13,15-16,18H2,1H3,(H,29,34)

InChI Key

CABXDCYCLMXTFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09239162

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.979

Distribution Coefficient, logD

2.977

Water Solubility, LogSw

-3.36

Polar Surface Area

54.810

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

G876-0745 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with G876-0745 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G876-0745?
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What is the minimum amount of G876-0745 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G876-0745
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G876-0745
  • 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 G876-0745 available by request