A0019157 Screening compound: 5-{[(1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

A0019157 Screening compound: 5-{[(1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
A0019157 Screening compound: 5-{[(1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound A0019157
5-{[(1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

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

A0019157

Molecular Formula

C26H19N5O2S3 (C26 H19 N5 O2 S3)

Compound Name

5-{[(1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

IUPAC name

5-{[(1H-13-benzodiazol-2-yl)methyl]sulfanyl}-6-(2-methoxyphenyl)-3-phenyl-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-7-one

SMILES

COc(cccc1)c1N(C1=O)C(SCc2nc(cccc3)c3[nH]2)=NC(N2c3ccccc3)=C1SC2=S

InChI

InChI=1S/C26H19N5O2S3/c1-33-20-14-8-7-13-19(20)31-24(32)22-23(30(26(34)36-22)16-9-3-2-4-10-16)29-25(31)35-15-21-27-17-11-5-6-12-18(17)28-21/h2-14H,15H2,1H3,(H,27,28)

InChI Key

GMDLBIIFOYXSGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02649142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

529.67

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.075

Distribution Coefficient, logD

5.075

Water Solubility, LogSw

-4.71

Polar Surface Area

54.566

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

3.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

A0019157 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with A0019157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound A0019157?
Check Price and Availability of A0019157, 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 A0019157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for A0019157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for A0019157
  • 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 A0019157 available by request