C365-0221 Screening compound: N-(4-bromophenyl)-2-{[1-(4-methylphenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide

C365-0221 Screening compound: N-(4-bromophenyl)-2-{[1-(4-methylphenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
C365-0221 Screening compound: N-(4-bromophenyl)-2-{[1-(4-methylphenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C365-0221
N-(4-bromophenyl)-2-{[1-(4-methylphenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide

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

C365-0221

Molecular Formula

C20H16BrN5O2S (C20 H16 BrN5 O2 S)

Compound Name

N-(4-bromophenyl)-2-{[1-(4-methylphenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide

IUPAC name

N-(4-bromophenyl)-2-{[1-(4-methylphenyl)-4-oxo-1H4H5H-pyrazolo[34-d]pyrimidin-6-yl]sulfanyl}acetamide

SMILES

Cc(cc1)ccc1-n1ncc(C(N2)=O)c1N=C2SCC(Nc(cc1)ccc1Br)=O

InChI

InChI=1S/C20H16BrN5O2S/c1-12-2-8-15(9-3-12)26-18-16(10-22-26)19(28)25-20(24-18)29-11-17(27)23-14-6-4-13(21)5-7-14/h2-10H,11H2,1H3,(H,23,27)(H,24,25,28)

InChI Key

ZFKPKGTYXBPGIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04456450

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.367

Distribution Coefficient, logD

4.304

Water Solubility, LogSw

-4.17

Polar Surface Area

71.601

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

-0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with C365-0221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C365-0221?
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What is the minimum amount of C365-0221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C365-0221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C365-0221
  • 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 C365-0221 available by request