5769-0080 Screening compound: 1,3-diphenyltetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione

5769-0080 Screening compound: 1,3-diphenyltetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione
5769-0080 Screening compound: 1,3-diphenyltetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 5769-0080
1,3-diphenyltetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-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

5769-0080

Molecular Formula

C17H16N2O3S (C17 H16 N2 O3 S)

Compound Name

1,3-diphenyltetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione

IUPAC name

13-diphenyl-hexahydro-1H-5lambda6-thieno[34-d]imidazole-255-trione

SMILES

O=C(N(C(C1)C2CS1(=O)=O)c1ccccc1)N2c1ccccc1

InChI

InChI=1S/C17H16N2O3S/c20-17-18(13-7-3-1-4-8-13)15-11-23(21,22)12-16(15)19(17)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2

InChI Key

HXVCOKHYQUJOBD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.588

Distribution Coefficient, logD

1.588

Water Solubility, LogSw

-2.14

Polar Surface Area

45.962

Acid Dissociation Constant (pKa)

19.15

Base Dissociation Constant (pKb)

-7.54

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 5769-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5769-0080?
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What is the minimum amount of 5769-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5769-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5769-0080
  • 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 5769-0080 available by request