Y030-5493 Screening compound: ethyl [(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]formate

Y030-5493 Screening compound: ethyl [(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]formate
Y030-5493 Screening compound: ethyl [(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]formate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-5493
ethyl [(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]formate

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

Y030-5493

Molecular Formula

C12H12N2O3S (C12 H12 N2 O3 S)

Compound Name

ethyl [(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]formate

IUPAC name

ethyl [(6-methyl-13-benzothiazol-2-yl)carbamoyl]formate

SMILES

CCOC(C(Nc1nc(ccc(C)c2)c2s1)=O)=O

InChI

InChI=1S/C12H12N2O3S/c1-3-17-11(16)10(15)14-12-13-8-5-4-7(2)6-9(8)18-12/h4-6H,3H2,1-2H3,(H,13,14,15)

InChI Key

FEDKXZRSVIBYDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01672599

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.050

Distribution Coefficient, logD

2.875

Water Solubility, LogSw

-3.19

Polar Surface Area

54.116

Acid Dissociation Constant (pKa)

7.70

Base Dissociation Constant (pKb)

1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

Y030-5493 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • GPCR
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y030-5493 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-5493?
Check Price and Availability of Y030-5493, 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 Y030-5493 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-5493
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-5493
  • 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 Y030-5493 available by request