Y070-1033 Screening compound: 6-phenyl-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-5-one

Y070-1033 Screening compound: 6-phenyl-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-5-one
Y070-1033 Screening compound: 6-phenyl-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-1033
6-phenyl-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-5-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

Y070-1033

Molecular Formula

C9H7N3OS (C9 H7 N3 OS)

Compound Name

6-phenyl-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-5-one

IUPAC name

6-phenyl-3-sulfanylidene-2345-tetrahydro-124-triazin-5-one

SMILES

O=C(C(c1ccccc1)=NN1)NC1=S

InChI

InChI=1S/C9H7N3OS/c13-8-7(11-12-9(14)10-8)6-4-2-1-3-5-6/h1-5H,(H2,10,12,13,14)

InChI Key

WAQGGKJKDGJEEA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01183869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

205.24

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.911

Distribution Coefficient, logD

1.778

Water Solubility, LogSw

-2.47

Polar Surface Area

47.617

Acid Dissociation Constant (pKa)

7.84

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y070-1033 in Drug Discovery

Included in Screening Libraries

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y070-1033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-1033?
Check Price and Availability of Y070-1033, 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 Y070-1033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-1033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-1033
  • 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 Y070-1033 available by request