R052-0650 Screening compound: 3-(10H-phenothiazin-10-yl)propanoic acid

R052-0650 Screening compound: 3-(10H-phenothiazin-10-yl)propanoic acid
R052-0650 Screening compound: 3-(10H-phenothiazin-10-yl)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R052-0650
3-(10H-phenothiazin-10-yl)propanoic 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

R052-0650

Molecular Formula

C15H13NO2S (C15 H13 NO2 S)

Compound Name

3-(10H-phenothiazin-10-yl)propanoic acid

IUPAC name

3-(10H-phenothiazin-10-yl)propanoic acid

SMILES

OC(CCN1c(cccc2)c2Sc2c1cccc2)=O

InChI

InChI=1S/C15H13NO2S/c17-15(18)9-10-16-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)16/h1-8H,9-10H2,(H,17,18)

InChI Key

VNTAONUWHQBAMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00156933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.390

Distribution Coefficient, logD

0.909

Water Solubility, LogSw

-3.60

Polar Surface Area

29.919

Acid Dissociation Constant (pKa)

4.92

Base Dissociation Constant (pKb)

-1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

R052-0650 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

DGK Inhibitors Library (10558 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with R052-0650 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R052-0650?
Check Price and Availability of R052-0650, 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 R052-0650 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R052-0650
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R052-0650
  • 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 R052-0650 available by request