Y010-1967 Screening compound: 5-[(E)-1-(benzylamino)ethylidene]-1-(4-bromophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

Y010-1967 Screening compound: 5-[(E)-1-(benzylamino)ethylidene]-1-(4-bromophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Y010-1967 Screening compound: 5-[(E)-1-(benzylamino)ethylidene]-1-(4-bromophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-1967
5-[(E)-1-(benzylamino)ethylidene]-1-(4-bromophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

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

Y010-1967

Molecular Formula

C19H16BrN3O3 (C19 H16 BrN3 O3)

Compound Name

5-[(E)-1-(benzylamino)ethylidene]-1-(4-bromophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

IUPAC name

(5E)-5-[1-(benzylamino)ethylidene]-1-(4-bromophenyl)-13-diazinane-246-trione

SMILES

C/C(/NCc1ccccc1)=C(/C(NC(N1c(cc2)ccc2Br)=O)=O)\C1=O

InChI

InChI=1S/C19H16BrN3O3/c1-12(21-11-13-5-3-2-4-6-13)16-17(24)22-19(26)23(18(16)25)15-9-7-14(20)8-10-15/h2-10,21H,11H2,1H3,(H,22,24,26)

InChI Key

INCKWWHYGYEPNS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06243626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.26

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

2.613

Distribution Coefficient, logD

1.908

Water Solubility, LogSw

-3.01

Polar Surface Area

64.934

Acid Dissociation Constant (pKa)

6.79

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.53

References: we are preparing a list of scientific research reports with Y010-1967 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-1967?
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What is the minimum amount of Y010-1967 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-1967
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-1967
  • 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 Y010-1967 available by request