3288-0490 Screening compound: (5E)-1-(4-chlorophenyl)-5-[(3-fluorophenyl)methylidene]-1,3-diazinane-2,4,6-trione

3288-0490 Screening compound: (5E)-1-(4-chlorophenyl)-5-[(3-fluorophenyl)methylidene]-1,3-diazinane-2,4,6-trione
3288-0490 Screening compound: (5E)-1-(4-chlorophenyl)-5-[(3-fluorophenyl)methylidene]-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3288-0490
(5E)-1-(4-chlorophenyl)-5-[(3-fluorophenyl)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

3288-0490

Molecular Formula

C17H10ClFN2O3 (C17 H10 ClFN2 O3)

Compound Name

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

IUPAC name

(5E)-1-(4-chlorophenyl)-5-[(3-fluorophenyl)methylidene]-13-diazinane-246-trione

SMILES

O=C(/C(/C(N1c(cc2)ccc2Cl)=O)=C\c2cc(F)ccc2)NC1=O

InChI

InChI=1S/C17H10ClFN2O3/c18-11-4-6-13(7-5-11)21-16(23)14(15(22)20-17(21)24)9-10-2-1-3-12(19)8-10/h1-9H,(H,20,22,24)

InChI Key

ONZXCPIOKCTWNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01655478

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.73

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

3.006

Distribution Coefficient, logD

2.703

Water Solubility, LogSw

-3.68

Polar Surface Area

53.391

Acid Dissociation Constant (pKa)

7.40

Base Dissociation Constant (pKb)

-6.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 3288-0490 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3288-0490?
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What is the minimum amount of 3288-0490 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3288-0490
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3288-0490
  • 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 3288-0490 available by request