6122-0012 Screening compound: N-(5-chloro-2-pyridyl)-2-[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetamide

6122-0012 Screening compound: N-(5-chloro-2-pyridyl)-2-[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetamide
6122-0012 Screening compound: N-(5-chloro-2-pyridyl)-2-[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6122-0012
N-(5-chloro-2-pyridyl)-2-[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetamide

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

6122-0012

Molecular Formula

C12H11ClN4O2S (C12 H11 ClN4 O2 S)

Compound Name

N-(5-chloro-2-pyridyl)-2-[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetamide

IUPAC name

n/a

SMILES

CC(N=C(N1)SCC(Nc(cc2)ncc2Cl)=O)=CC1=O

InChI

InChI=1S/C12H11ClN4O2S/c1-7-4-10(18)17-12(15-7)20-6-11(19)16-9-3-2-8(13)5-14-9/h2-5H,6H2,1H3,(H,14,16,19)(H,15,17,18)

InChI Key

SAEJKXVAJMDGMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04128725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.76

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.704

Distribution Coefficient, logD

0.982

Water Solubility, LogSw

-2.75

Polar Surface Area

67.154

Acid Dissociation Constant (pKa)

6.77

Base Dissociation Constant (pKb)

0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

6122-0012 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with 6122-0012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6122-0012?
Check Price and Availability of 6122-0012, 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 6122-0012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6122-0012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6122-0012
  • 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 6122-0012 available by request