2368-0183 Screening compound: (5E)-1-(4-chlorophenyl)-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

2368-0183 Screening compound: (5E)-1-(4-chlorophenyl)-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
2368-0183 Screening compound: (5E)-1-(4-chlorophenyl)-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2368-0183
(5E)-1-(4-chlorophenyl)-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

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

2368-0183

Molecular Formula

C15H9ClN2O3S (C15 H9 ClN2 O3 S)

Compound Name

(5E)-1-(4-chlorophenyl)-5-[(thiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

IUPAC name

(5E)-1-(4-chlorophenyl)-5-[(thiophen-2-yl)methylidene]-13-diazinane-246-trione

SMILES

O=C(/C(/C(N1c(cc2)ccc2Cl)=O)=C\c2cccs2)NC1=O

InChI

InChI=1S/C15H9ClN2O3S/c16-9-3-5-10(6-4-9)18-14(20)12(13(19)17-15(18)21)8-11-2-1-7-22-11/h1-8H,(H,17,19,21)

InChI Key

XYLSXYSCIIYVDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01541164

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.77

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.529

Distribution Coefficient, logD

2.126

Water Solubility, LogSw

-3.34

Polar Surface Area

54.409

Acid Dissociation Constant (pKa)

7.22

Base Dissociation Constant (pKb)

-7.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2368-0183 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Ion Channels Annotated Library (353 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2368-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2368-0183?
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What is the minimum amount of 2368-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2368-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2368-0183
  • 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 2368-0183 available by request