2368-1595 Screening compound: 5-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione

2368-1595 Screening compound: 5-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione
2368-1595 Screening compound: 5-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2368-1595
5-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-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

2368-1595

Molecular Formula

C27H18ClN3O3 (C27 H18 ClN3 O3)

Compound Name

5-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-1,3-diazinane-2,4,6-trione

IUPAC name

5-{[1-(4-chlorophenyl)-25-diphenyl-1H-pyrrol-3-yl]methylidene}-13-diazinane-246-trione

SMILES

O=C(C(C(N1)=O)=Cc(cc2-c3ccccc3)c(-c3ccccc3)n2-c(cc2)ccc2Cl)NC1=O

InChI

InChI=1S/C27H18ClN3O3/c28-20-11-13-21(14-12-20)31-23(17-7-3-1-4-8-17)16-19(24(31)18-9-5-2-6-10-18)15-22-25(32)29-27(34)30-26(22)33/h1-16H,(H2,29,30,32,33,34)

InChI Key

GUDUTAGZGOOLHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01611514

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.278

Distribution Coefficient, logD

4.962

Water Solubility, LogSw

-6.02

Polar Surface Area

62.824

Acid Dissociation Constant (pKa)

7.37

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2368-1595 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2368-1595 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2368-1595?
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What is the minimum amount of 2368-1595 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2368-1595
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2368-1595
  • 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 2368-1595 available by request