C200-8877 Screening compound: 4-({5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl}amino)-N-(2-phenylpropyl)benzamide

C200-8877 Screening compound: 4-({5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl}amino)-N-(2-phenylpropyl)benzamide
C200-8877 Screening compound: 4-({5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl}amino)-N-(2-phenylpropyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-8877
4-({5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl}amino)-N-(2-phenylpropyl)benzamide

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

C200-8877

Molecular Formula

C25H21N5O2S (C25 H21 N5 O2 S)

Compound Name

4-({5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl}amino)-N-(2-phenylpropyl)benzamide

IUPAC name

4-({5-oxo-5H-[134]thiadiazolo[23-b]quinazolin-2-yl}amino)-N-(2-phenylpropyl)benzamide

SMILES

CC(CNC(c(cc1)ccc1NC(SC1=Nc2c3cccc2)=NN1C3=O)=O)c1ccccc1

InChI

InChI=1S/C25H21N5O2S/c1-16(17-7-3-2-4-8-17)15-26-22(31)18-11-13-19(14-12-18)27-24-29-30-23(32)20-9-5-6-10-21(20)28-25(30)33-24/h2-14,16H,15H2,1H3,(H,26,31)(H,27,29)/t16-/m0/s1

InChI Key

VHBJEBFEGFFSBC-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14728928

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.311

Distribution Coefficient, logD

3.948

Water Solubility, LogSw

-4.30

Polar Surface Area

71.280

Acid Dissociation Constant (pKa)

7.28

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.00

C200-8877 in Drug Discovery

Included in Screening Libraries

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C200-8877 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-8877?
Check Price and Availability of C200-8877, 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 C200-8877 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-8877
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-8877
  • 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 C200-8877 available by request