P209-0562 Screening compound: N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-(methylsulfanyl)pyridine-3-carboxamide

P209-0562 Screening compound: N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-(methylsulfanyl)pyridine-3-carboxamide
P209-0562 Screening compound: N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-(methylsulfanyl)pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P209-0562
N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-(methylsulfanyl)pyridine-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

P209-0562

Molecular Formula

C17H21N5OS (C17 H21 N5 OS)

Compound Name

N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-(methylsulfanyl)pyridine-3-carboxamide

IUPAC name

N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-(methylsulfanyl)pyridine-3-carboxamide

SMILES

CSc1ncccc1C(Nc1cnc(N2CCCCCC2)nc1)=O

InChI

InChI=1S/C17H21N5OS/c1-24-16-14(7-6-8-18-16)15(23)21-13-11-19-17(20-12-13)22-9-4-2-3-5-10-22/h6-8,11-12H,2-5,9-10H2,1H3,(H,21,23)

InChI Key

RGYRAIVBHBBCPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27569235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.006

Distribution Coefficient, logD

2.997

Water Solubility, LogSw

-3.44

Polar Surface Area

54.834

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

5.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

P209-0562 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P209-0562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P209-0562?
Check Price and Availability of P209-0562, 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 P209-0562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P209-0562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P209-0562
  • 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 P209-0562 available by request