3202-0392 Screening compound: (5Z)-5-({3-ethoxy-4-[2-(naphthalen-1-ylsulfanyl)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

3202-0392 Screening compound: (5Z)-5-({3-ethoxy-4-[2-(naphthalen-1-ylsulfanyl)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
3202-0392 Screening compound: (5Z)-5-({3-ethoxy-4-[2-(naphthalen-1-ylsulfanyl)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3202-0392
(5Z)-5-({3-ethoxy-4-[2-(naphthalen-1-ylsulfanyl)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

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

3202-0392

Molecular Formula

C32H28N2O5S2 (C32 H28 N2 O5 S2)

Compound Name

(5Z)-5-({3-ethoxy-4-[2-(naphthalen-1-ylsulfanyl)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

IUPAC name

(5Z)-5-({3-ethoxy-4-[2-(naphthalen-1-ylsulfanyl)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-13-diazinane-46-dione

SMILES

CCOc(cc(/C=C(/C(NC(N1c(cc2)ccc2OC)=S)=O)\C1=O)cc1)c1OCCSc1cccc2ccccc12

InChI

InChI=1S/C32H28N2O5S2/c1-3-38-28-20-21(11-16-27(28)39-17-18-41-29-10-6-8-22-7-4-5-9-25(22)29)19-26-30(35)33-32(40)34(31(26)36)23-12-14-24(37-2)15-13-23/h4-16,19-20H,3,17-18H2,1-2H3,(H,33,35,40)

InChI Key

PFMMORWWQIHYOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02017803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

584.72

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.445

Distribution Coefficient, logD

5.070

Water Solubility, LogSw

-6.49

Polar Surface Area

61.944

Acid Dissociation Constant (pKa)

7.26

Base Dissociation Constant (pKb)

-7.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.60

3202-0392 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 3202-0392 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3202-0392?
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What is the minimum amount of 3202-0392 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3202-0392
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3202-0392
  • 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 3202-0392 available by request