H025-0708B Screening compound: 3-[3-(benzenesulfonyl)-2-(methylsulfanyl)-5-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine

H025-0708B Screening compound: 3-[3-(benzenesulfonyl)-2-(methylsulfanyl)-5-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine
H025-0708B Screening compound: 3-[3-(benzenesulfonyl)-2-(methylsulfanyl)-5-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound H025-0708B
3-[3-(benzenesulfonyl)-2-(methylsulfanyl)-5-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine

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

H025-0708B

Molecular Formula

C23H17N5O2S2 (C23 H17 N5 O2 S2)

Compound Name

3-[3-(benzenesulfonyl)-2-(methylsulfanyl)-5-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine

IUPAC name

3-[3-(benzenesulfonyl)-2-(methylsulfanyl)-5-(pyridin-3-yl)pyrazolo[15-a]pyrimidin-7-yl]pyridine

SMILES

CSc1nn2c(-c3cnccc3)cc(-c3cnccc3)nc2c1S(c1ccccc1)(=O)=O

InChI

InChI=1S/C23H17N5O2S2/c1-31-23-21(32(29,30)18-9-3-2-4-10-18)22-26-19(16-7-5-11-24-14-16)13-20(28(22)27-23)17-8-6-12-25-15-17/h2-15H,1H3

InChI Key

VEGOBDPLEOVZIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27214665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.209

Distribution Coefficient, logD

3.198

Water Solubility, LogSw

-3.38

Polar Surface Area

67.340

Acid Dissociation Constant (pKa)

29.11

Base Dissociation Constant (pKb)

5.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

H025-0708B in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with H025-0708B chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H025-0708B?
Check Price and Availability of H025-0708B, 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 H025-0708B you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H025-0708B
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H025-0708B
  • 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 H025-0708B available by request