C127-0124 Screening compound: N-{2-[butyl(methyl)amino]ethyl}-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

C127-0124 Screening compound: N-{2-[butyl(methyl)amino]ethyl}-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
C127-0124 Screening compound: N-{2-[butyl(methyl)amino]ethyl}-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C127-0124
N-{2-[butyl(methyl)amino]ethyl}-1-(6-ethyl-1,3-benzothiazol-2-yl)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

C127-0124

Molecular Formula

C22H34N4OS (C22 H34 N4 OS)

Compound Name

N-{2-[butyl(methyl)amino]ethyl}-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

IUPAC name

N-{2-[butyl(methyl)amino]ethyl}-1-(6-ethyl-13-benzothiazol-2-yl)piperidine-4-carboxamide

SMILES

CCCCN(C)CCNC(C(CC1)CCN1c1nc(ccc(CC)c2)c2s1)=O

InChI

InChI=1S/C22H34N4OS/c1-4-6-12-25(3)15-11-23-21(27)18-9-13-26(14-10-18)22-24-19-8-7-17(5-2)16-20(19)28-22/h7-8,16,18H,4-6,9-15H2,1-3H3,(H,23,27)

InChI Key

IUZPHVKJWOBQSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14721131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.6

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.447

Distribution Coefficient, logD

2.695

Water Solubility, LogSw

-4.07

Polar Surface Area

41.825

Acid Dissociation Constant (pKa)

13.35

Base Dissociation Constant (pKb)

9.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.60

C127-0124 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

CNS BBB Library (22607 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C127-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C127-0124?
Check Price and Availability of C127-0124, 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 C127-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C127-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C127-0124
  • 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 C127-0124 available by request