Y070-0600 Screening compound: methyl N-[1-(1,3-benzothiazol-2-ylsulfanyl)-2-oxo-2-(thiophen-2-yl)ethyl]carbamate

Y070-0600 Screening compound: methyl N-[1-(1,3-benzothiazol-2-ylsulfanyl)-2-oxo-2-(thiophen-2-yl)ethyl]carbamate
Y070-0600 Screening compound: methyl N-[1-(1,3-benzothiazol-2-ylsulfanyl)-2-oxo-2-(thiophen-2-yl)ethyl]carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0600
methyl N-[1-(1,3-benzothiazol-2-ylsulfanyl)-2-oxo-2-(thiophen-2-yl)ethyl]carbamate

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

Y070-0600

Molecular Formula

C15H12N2O3S3 (C15 H12 N2 O3 S3)

Compound Name

methyl N-[1-(1,3-benzothiazol-2-ylsulfanyl)-2-oxo-2-(thiophen-2-yl)ethyl]carbamate

IUPAC name

methyl N-[1-(13-benzothiazol-2-ylsulfanyl)-2-oxo-2-(thiophen-2-yl)ethyl]carbamate

SMILES

COC(NC(C(c1cccs1)=O)Sc1nc(cccc2)c2s1)=O

InChI

InChI=1S/C15H12N2O3S3/c1-20-14(19)17-13(12(18)11-7-4-8-21-11)23-15-16-9-5-2-3-6-10(9)22-15/h2-8,13H,1H3,(H,17,19)/t13-/m0/s1

InChI Key

NHZQAAZQTHAFAQ-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03463277

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.115

Distribution Coefficient, logD

4.115

Water Solubility, LogSw

-4.30

Polar Surface Area

55.896

Acid Dissociation Constant (pKa)

10.46

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.33

Y070-0600 in Drug Discovery

Included in Screening Libraries

NOTUM (Wnt signaling) Library (3881 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with Y070-0600 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0600?
Check Price and Availability of Y070-0600, 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 Y070-0600 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0600
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0600
  • 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 Y070-0600 available by request