H025-3104C Screening compound: 2-[5-methyl-2-(methylsulfanyl)-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-7-yl]-1-ethanamine

H025-3104C Screening compound: 2-[5-methyl-2-(methylsulfanyl)-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-7-yl]-1-ethanamine
H025-3104C Screening compound: 2-[5-methyl-2-(methylsulfanyl)-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-7-yl]-1-ethanamine alternative view

Chemical Structure Depiction of ChemDiv screening compound H025-3104C
2-[5-methyl-2-(methylsulfanyl)-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-7-yl]-1-ethanamine

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

H025-3104C

Molecular Formula

C16H18N4O2S2 (C16 H18 N4 O2 S2)

Compound Name

2-[5-methyl-2-(methylsulfanyl)-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-7-yl]-1-ethanamine

IUPAC name

2-[3-(benzenesulfonyl)-5-methyl-2-(methylsulfanyl)pyrazolo[15-a]pyrimidin-7-yl]ethan-1-amine

SMILES

Cc(cc(CCN)n1nc2SC)nc1c2S(c1ccccc1)(=O)=O

InChI

InChI=1S/C16H18N4O2S2/c1-11-10-12(8-9-17)20-15(18-11)14(16(19-20)23-2)24(21,22)13-6-4-3-5-7-13/h3-7,10H,8-9,17H2,1-2H3

InChI Key

ADMGHURBEKWJRC-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

362.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.356

Distribution Coefficient, logD

-1.199

Water Solubility, LogSw

-2.24

Polar Surface Area

70.291

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

9.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

H025-3104C in Drug Discovery

Included in Screening Libraries

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 H025-3104C chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H025-3104C?
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What is the minimum amount of H025-3104C you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H025-3104C
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H025-3104C
  • 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 H025-3104C available by request