D487-0330 Screening compound: 2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]-N-phenylacetamide

D487-0330 Screening compound: 2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]-N-phenylacetamide
D487-0330 Screening compound: 2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D487-0330
2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]-N-phenylacetamide

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

D487-0330

Molecular Formula

C11H10N4O2S (C11 H10 N4 O2 S)

Compound Name

2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]-N-phenylacetamide

IUPAC name

2-[(3-hydroxy-124-triazin-5-yl)sulfanyl]-N-phenylacetamide

SMILES

Oc1nncc(SCC(Nc2ccccc2)=O)n1

InChI

InChI=1S/C11H10N4O2S/c16-9(13-8-4-2-1-3-5-8)7-18-10-6-12-15-11(17)14-10/h1-6H,7H2,(H,13,16)(H,14,15,17)

InChI Key

KFDVIXMRBJHWHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12922344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.627

Distribution Coefficient, logD

0.607

Water Solubility, LogSw

-2.00

Polar Surface Area

72.006

Acid Dissociation Constant (pKa)

8.75

Base Dissociation Constant (pKb)

1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

D487-0330 in Drug Discovery

Included in Screening Libraries

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D487-0330 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D487-0330?
Check Price and Availability of D487-0330, 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 D487-0330 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D487-0330
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D487-0330
  • 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 D487-0330 available by request