5183-0219 Screening compound: 2-[2-(pyrimidin-2-ylsulfanyl)acetamido]benzoic acid

5183-0219 Screening compound: 2-[2-(pyrimidin-2-ylsulfanyl)acetamido]benzoic acid
5183-0219 Screening compound: 2-[2-(pyrimidin-2-ylsulfanyl)acetamido]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5183-0219
2-[2-(pyrimidin-2-ylsulfanyl)acetamido]benzoic acid

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

5183-0219

Molecular Formula

C13H11N3O3S (C13 H11 N3 O3 S)

Compound Name

2-[2-(pyrimidin-2-ylsulfanyl)acetamido]benzoic acid

IUPAC name

2-[2-(pyrimidin-2-ylsulfanyl)acetamido]benzoic acid

SMILES

OC(c(cccc1)c1NC(CSc1ncccn1)=O)=O

InChI

InChI=1S/C13H11N3O3S/c17-11(8-20-13-14-6-3-7-15-13)16-10-5-2-1-4-9(10)12(18)19/h1-7H,8H2,(H,16,17)(H,18,19)

InChI Key

JATNSTMICLPIJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03271563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.31

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.825

Distribution Coefficient, logD

-2.588

Water Solubility, LogSw

-2.69

Polar Surface Area

68.984

Acid Dissociation Constant (pKa)

2.99

Base Dissociation Constant (pKb)

-1.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

References: we are preparing a list of scientific research reports with 5183-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5183-0219?
Check Price and Availability of 5183-0219, 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 5183-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5183-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5183-0219
  • 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 5183-0219 available by request