S618-1492 Screening compound: N-{[3-(DIMETHYLAMINO)-1-[(4-FLUORO-3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL]METHYL}-2-METHOXYACETAMIDE

S618-1492 Screening compound: N-{[3-(DIMETHYLAMINO)-1-[(4-FLUORO-3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL]METHYL}-2-METHOXYACETAMIDE
S618-1492 Screening compound: N-{[3-(DIMETHYLAMINO)-1-[(4-FLUORO-3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL]METHYL}-2-METHOXYACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S618-1492
N-{[3-(DIMETHYLAMINO)-1-[(4-FLUORO-3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL]METHYL}-2-METHOXYACETAMIDE

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

S618-1492

Molecular Formula

C19H30FN3O3 (C19 H30 FN3 O3)

Compound Name

N-{[3-(DIMETHYLAMINO)-1-[(4-FLUORO-3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL]METHYL}-2-METHOXYACETAMIDE

IUPAC name

N-{[(3S4R)-3-(dimethylamino)-1-[(4-fluoro-3-methoxyphenyl)methyl]piperidin-4-yl]methyl}-2-methoxyacetamide

SMILES

CN(C)[C@@H]1[C@H](CNC(COC)=O)CCN(Cc(cc2)cc(OC)c2F)C1

InChI

InChI=1S/C19H30FN3O3/c1-22(2)17-12-23(8-7-15(17)10-21-19(24)13-25-3)11-14-5-6-16(20)18(9-14)26-4/h5-6,9,15,17H,7-8,10-13H2,1-4H3,(H,21,24)/t15-,17+/m1/s1

InChI Key

PLTXHFOCISASJZ-WBVHZDCISA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.646

Distribution Coefficient, logD

-1.765

Water Solubility, LogSw

-2.15

Polar Surface Area

46.341

Acid Dissociation Constant (pKa)

14.85

Base Dissociation Constant (pKb)

9.81

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

63.20

S618-1492 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with S618-1492 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S618-1492?
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What is the minimum amount of S618-1492 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S618-1492
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S618-1492
  • 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 S618-1492 available by request