H025-0535B Screening compound: 2-(ethylsulfanyl)-5,7-dimethyl-3-[(4-methylphenyl)sulfonyl]pyrazolo[1,5-a]pyrimidine

H025-0535B Screening compound: 2-(ethylsulfanyl)-5,7-dimethyl-3-[(4-methylphenyl)sulfonyl]pyrazolo[1,5-a]pyrimidine
H025-0535B Screening compound: 2-(ethylsulfanyl)-5,7-dimethyl-3-[(4-methylphenyl)sulfonyl]pyrazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound H025-0535B
2-(ethylsulfanyl)-5,7-dimethyl-3-[(4-methylphenyl)sulfonyl]pyrazolo[1,5-a]pyrimidine

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

H025-0535B

Molecular Formula

C17H19N3O2S2 (C17 H19 N3 O2 S2)

Compound Name

2-(ethylsulfanyl)-5,7-dimethyl-3-[(4-methylphenyl)sulfonyl]pyrazolo[1,5-a]pyrimidine

IUPAC name

2-(ethylsulfanyl)-57-dimethyl-3-(4-methylbenzenesulfonyl)pyrazolo[15-a]pyrimidine

SMILES

CCSc1nn2c(C)cc(C)nc2c1S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C17H19N3O2S2/c1-5-23-17-15(16-18-12(3)10-13(4)20(16)19-17)24(21,22)14-8-6-11(2)7-9-14/h6-10H,5H2,1-4H3

InChI Key

IXOXGCPBSATXGI-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.304

Distribution Coefficient, logD

3.304

Water Solubility, LogSw

-3.48

Polar Surface Area

49.625

Acid Dissociation Constant (pKa)

25.98

Base Dissociation Constant (pKb)

-1.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.41

H025-0535B in Drug Discovery

Included in Screening Libraries

CNS Annotated Library (688 compounds)

Human GPCR Annotated Library (5539 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with H025-0535B chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H025-0535B?
Check Price and Availability of H025-0535B, 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 H025-0535B you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H025-0535B
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H025-0535B
  • 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 H025-0535B available by request