G747-0042 Screening compound: 1-benzyl-3-[(4-ethylpiperazin-1-yl)(4-fluorophenyl)methyl]-4-hydroxy-6-methyl-1,2-dihydropyridin-2-one

G747-0042 Screening compound: 1-benzyl-3-[(4-ethylpiperazin-1-yl)(4-fluorophenyl)methyl]-4-hydroxy-6-methyl-1,2-dihydropyridin-2-one
G747-0042 Screening compound: 1-benzyl-3-[(4-ethylpiperazin-1-yl)(4-fluorophenyl)methyl]-4-hydroxy-6-methyl-1,2-dihydropyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G747-0042
1-benzyl-3-[(4-ethylpiperazin-1-yl)(4-fluorophenyl)methyl]-4-hydroxy-6-methyl-1,2-dihydropyridin-2-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

G747-0042

Molecular Formula

C26H30FN3O2 (C26 H30 FN3 O2)

Compound Name

1-benzyl-3-[(4-ethylpiperazin-1-yl)(4-fluorophenyl)methyl]-4-hydroxy-6-methyl-1,2-dihydropyridin-2-one

IUPAC name

1-benzyl-3-[(4-ethylpiperazin-1-yl)(4-fluorophenyl)methyl]-4-hydroxy-6-methyl-12-dihydropyridin-2-one

SMILES

CCN(CC1)CCN1C(c(cc1)ccc1F)C(C(N(Cc1ccccc1)C(C)=C1)=O)=C1O

InChI

InChI=1S/C26H30FN3O2/c1-3-28-13-15-29(16-14-28)25(21-9-11-22(27)12-10-21)24-23(31)17-19(2)30(26(24)32)18-20-7-5-4-6-8-20/h4-12,17,25,31H,3,13-16,18H2,1-2H3/t25-/m0/s1

InChI Key

XMGUXSJULBIRLU-VWLOTQADSA-N

MDL Number (MFCD)

MFCD09237436

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.787

Distribution Coefficient, logD

3.787

Water Solubility, LogSw

-3.77

Polar Surface Area

36.895

Acid Dissociation Constant (pKa)

5.50

Base Dissociation Constant (pKb)

8.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with G747-0042 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G747-0042?
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What is the minimum amount of G747-0042 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G747-0042
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G747-0042
  • 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 G747-0042 available by request