D264-0174 Screening compound: N-[4-(methylsulfanyl)phenyl]-1-(pyrimidin-2-yl)piperidine-4-carboxamide

D264-0174 Screening compound: N-[4-(methylsulfanyl)phenyl]-1-(pyrimidin-2-yl)piperidine-4-carboxamide
D264-0174 Screening compound: N-[4-(methylsulfanyl)phenyl]-1-(pyrimidin-2-yl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D264-0174
N-[4-(methylsulfanyl)phenyl]-1-(pyrimidin-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

D264-0174

Molecular Formula

C17H20N4OS (C17 H20 N4 OS)

Compound Name

N-[4-(methylsulfanyl)phenyl]-1-(pyrimidin-2-yl)piperidine-4-carboxamide

IUPAC name

N-[4-(methylsulfanyl)phenyl]-1-(pyrimidin-2-yl)piperidine-4-carboxamide

SMILES

CSc(cc1)ccc1NC(C(CC1)CCN1c1ncccn1)=O

InChI

InChI=1S/C17H20N4OS/c1-23-15-5-3-14(4-6-15)20-16(22)13-7-11-21(12-8-13)17-18-9-2-10-19-17/h2-6,9-10,13H,7-8,11-12H2,1H3,(H,20,22)

InChI Key

SYWOQGBCJQTMNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14815774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.145

Distribution Coefficient, logD

3.145

Water Solubility, LogSw

-3.30

Polar Surface Area

45.144

Acid Dissociation Constant (pKa)

11.73

Base Dissociation Constant (pKb)

9.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

D264-0174 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

CNS MPO Library (28609 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D264-0174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D264-0174?
Check Price and Availability of D264-0174, 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 D264-0174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D264-0174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D264-0174
  • 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 D264-0174 available by request