3374-0815 Screening compound: (5Z)-5-({4-[2-(4-cyclohexylphenoxy)ethoxy]phenyl}methylidene)-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione

3374-0815 Screening compound: (5Z)-5-({4-[2-(4-cyclohexylphenoxy)ethoxy]phenyl}methylidene)-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
3374-0815 Screening compound: (5Z)-5-({4-[2-(4-cyclohexylphenoxy)ethoxy]phenyl}methylidene)-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3374-0815
(5Z)-5-({4-[2-(4-cyclohexylphenoxy)ethoxy]phenyl}methylidene)-1-(3-methylphenyl)-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

3374-0815

Molecular Formula

C32H32N2O5 (C32 H32 N2 O5)

Compound Name

(5Z)-5-({4-[2-(4-cyclohexylphenoxy)ethoxy]phenyl}methylidene)-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione

IUPAC name

(5Z)-5-({4-[2-(4-cyclohexylphenoxy)ethoxy]phenyl}methylidene)-1-(3-methylphenyl)-13-diazinane-246-trione

SMILES

Cc1cccc(N(C(/C(/C(N2)=O)=C\c(cc3)ccc3OCCOc3ccc(C4CCCCC4)cc3)=O)C2=O)c1

InChI

InChI=1S/C32H32N2O5/c1-22-6-5-9-26(20-22)34-31(36)29(30(35)33-32(34)37)21-23-10-14-27(15-11-23)38-18-19-39-28-16-12-25(13-17-28)24-7-3-2-4-8-24/h5-6,9-17,20-21,24H,2-4,7-8,18-19H2,1H3,(H,33,35,37)

InChI Key

HEVNEZXSESUCEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02067672

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.696

Distribution Coefficient, logD

6.620

Water Solubility, LogSw

-5.51

Polar Surface Area

67.875

Acid Dissociation Constant (pKa)

8.12

Base Dissociation Constant (pKb)

-5.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.10

3374-0815 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3374-0815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3374-0815?
Check Price and Availability of 3374-0815, 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 3374-0815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3374-0815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3374-0815
  • 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 3374-0815 available by request