6220-1323 Screening compound: 1-(3,4-dihydroxyphenyl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one

6220-1323 Screening compound: 1-(3,4-dihydroxyphenyl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one
6220-1323 Screening compound: 1-(3,4-dihydroxyphenyl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6220-1323
1-(3,4-dihydroxyphenyl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one

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

6220-1323

Molecular Formula

C12H10N2O3S (C12 H10 N2 O3 S)

Compound Name

1-(3,4-dihydroxyphenyl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one

IUPAC name

1-(34-dihydroxyphenyl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one

SMILES

Oc(ccc(C(CSc1ncccn1)=O)c1)c1O

InChI

InChI=1S/C12H10N2O3S/c15-9-3-2-8(6-10(9)16)11(17)7-18-12-13-4-1-5-14-12/h1-6,15-16H,7H2

InChI Key

RDCTUZFAHOHAHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01305894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.296

Distribution Coefficient, logD

1.114

Water Solubility, LogSw

-1.97

Polar Surface Area

64.467

Acid Dissociation Constant (pKa)

7.68

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

6220-1323 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6220-1323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6220-1323?
Check Price and Availability of 6220-1323, 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 6220-1323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6220-1323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6220-1323
  • 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 6220-1323 available by request