H025-3081 Screening compound: ethyl 2-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]acetate

H025-3081 Screening compound: ethyl 2-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]acetate
H025-3081 Screening compound: ethyl 2-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound H025-3081
ethyl 2-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]acetate

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

H025-3081

Molecular Formula

C19H21N3O4S2 (C19 H21 N3 O4 S2)

Compound Name

ethyl 2-[3-(benzenesulfonyl)-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]acetate

IUPAC name

ethyl 2-[3-(benzenesulfonyl)-57-dimethyl-2-(methylsulfanyl)pyrazolo[15-a]pyrimidin-6-yl]acetate

SMILES

CCOC(Cc(c(C)nc1c2S(c3ccccc3)(=O)=O)c(C)n1nc2SC)=O

InChI

InChI=1S/C19H21N3O4S2/c1-5-26-16(23)11-15-12(2)20-18-17(19(27-4)21-22(18)13(15)3)28(24,25)14-9-7-6-8-10-14/h6-10H,5,11H2,1-4H3

InChI Key

ZMSAZFBPEBSOKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27644377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.776

Distribution Coefficient, logD

2.776

Water Solubility, LogSw

-3.13

Polar Surface Area

70.330

Acid Dissociation Constant (pKa)

13.62

Base Dissociation Constant (pKb)

1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

H025-3081 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Nucleoside Mimetics Library (2197 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with H025-3081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H025-3081?
Check Price and Availability of H025-3081, 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 H025-3081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H025-3081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H025-3081
  • 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 H025-3081 available by request