G855-0679 Screening compound: 1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-{[4-(dimethylamino)phenyl]methyl}piperidine-4-carboxamide

G855-0679 Screening compound: 1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-{[4-(dimethylamino)phenyl]methyl}piperidine-4-carboxamide
G855-0679 Screening compound: 1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-{[4-(dimethylamino)phenyl]methyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G855-0679
1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-{[4-(dimethylamino)phenyl]methyl}piperidine-4-carboxamide

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

G855-0679

Molecular Formula

C26H34N4O4S (C26 H34 N4 O4 S)

Compound Name

1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-{[4-(dimethylamino)phenyl]methyl}piperidine-4-carboxamide

IUPAC name

1-[(1-acetyl-1234-tetrahydroquinolin-6-yl)sulfonyl]-N-{[4-(dimethylamino)phenyl]methyl}piperidine-4-carboxamide

SMILES

CC(N(CCC1)c(cc2)c1cc2S(N(CC1)CCC1C(NCc(cc1)ccc1N(C)C)=O)(=O)=O)=O

InChI

InChI=1S/C26H34N4O4S/c1-19(31)30-14-4-5-22-17-24(10-11-25(22)30)35(33,34)29-15-12-21(13-16-29)26(32)27-18-20-6-8-23(9-7-20)28(2)3/h6-11,17,21H,4-5,12-16,18H2,1-3H3,(H,27,32)

InChI Key

VHGAYZQKZXIIPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15041142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.247

Distribution Coefficient, logD

2.231

Water Solubility, LogSw

-2.91

Polar Surface Area

75.220

Acid Dissociation Constant (pKa)

13.43

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

G855-0679 in Drug Discovery

Included in Screening Libraries

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

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G855-0679 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G855-0679?
Check Price and Availability of G855-0679, 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 G855-0679 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G855-0679
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G855-0679
  • 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 G855-0679 available by request