C618-0390 Screening compound: 1-{2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]acetyl}piperidine-4-carboxamide

C618-0390 Screening compound: 1-{2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]acetyl}piperidine-4-carboxamide
C618-0390 Screening compound: 1-{2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]acetyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C618-0390
1-{2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]acetyl}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

C618-0390

Molecular Formula

C21H24ClN3O2S (C21 H24 ClN3 O2 S)

Compound Name

1-{2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]acetyl}piperidine-4-carboxamide

IUPAC name

1-{2-[(6-chloro-1234-tetrahydroacridin-9-yl)sulfanyl]acetyl}piperidine-4-carboxamide

SMILES

NC(C(CC1)CCN1C(CSc1c(ccc(Cl)c2)c2nc2c1CCCC2)=O)=O

InChI

InChI=1S/C21H24ClN3O2S/c22-14-5-6-16-18(11-14)24-17-4-2-1-3-15(17)20(16)28-12-19(26)25-9-7-13(8-10-25)21(23)27/h5-6,11,13H,1-4,7-10,12H2,(H2,23,27)

InChI Key

AMXKULLHVAMIOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14777313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.395

Distribution Coefficient, logD

2.944

Water Solubility, LogSw

-3.88

Polar Surface Area

60.170

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

7.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

C618-0390 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C618-0390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C618-0390?
Check Price and Availability of C618-0390, 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 C618-0390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C618-0390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C618-0390
  • 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 C618-0390 available by request