G855-0861 Screening compound: 1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-3-carboxamide

G855-0861 Screening compound: 1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-3-carboxamide
G855-0861 Screening compound: 1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G855-0861
1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-3-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

G855-0861

Molecular Formula

C25H29N3O6S (C25 H29 N3 O6 S)

Compound Name

1-[(1-acetyl-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-3-carboxamide

IUPAC name

1-[(1-acetyl-1234-tetrahydroquinolin-6-yl)sulfonyl]-N-[(2H-13-benzodioxol-5-yl)methyl]piperidine-3-carboxamide

SMILES

CC(N(CCC1)c(cc2)c1cc2S(N(CCC1)CC1C(NCc(cc1)cc2c1OCO2)=O)(=O)=O)=O

InChI

InChI=1S/C25H29N3O6S/c1-17(29)28-11-3-4-19-13-21(7-8-22(19)28)35(31,32)27-10-2-5-20(15-27)25(30)26-14-18-6-9-23-24(12-18)34-16-33-23/h6-9,12-13,20H,2-5,10-11,14-16H2,1H3,(H,26,30)/t20-/m0/s1

InChI Key

HKSLZICYMYHSRK-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD15041171

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.59

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.986

Distribution Coefficient, logD

1.986

Water Solubility, LogSw

-2.77

Polar Surface Area

89.464

Acid Dissociation Constant (pKa)

13.45

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

G855-0861 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G855-0861 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G855-0861?
Check Price and Availability of G855-0861, 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 G855-0861 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G855-0861
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G855-0861
  • 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 G855-0861 available by request