0327-0358 Screening compound: 5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

0327-0358 Screening compound: 5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
0327-0358 Screening compound: 5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0327-0358
5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

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

0327-0358

Molecular Formula

C12H10N2O3S (C12 H10 N2 O3 S)

Compound Name

5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

IUPAC name

5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-13-diazinane-46-dione

SMILES

COc1cccc(C=C(C(NC(N2)=S)=O)C2=O)c1

InChI

InChI=1S/C12H10N2O3S/c1-17-8-4-2-3-7(5-8)6-9-10(15)13-12(18)14-11(9)16/h2-6H,1H3,(H2,13,14,15,16,18)

InChI Key

UAKHOCOZKWNMAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00222387

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

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.935

Distribution Coefficient, logD

1.509

Water Solubility, LogSw

-2.69

Polar Surface Area

57.170

Acid Dissociation Constant (pKa)

7.18

Base Dissociation Constant (pKb)

-9.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

0327-0358 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 0327-0358 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0327-0358?
Check Price and Availability of 0327-0358, 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 0327-0358 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0327-0358
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0327-0358
  • 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 0327-0358 available by request