H025-3072C Screening compound: N-{[3-[(3-chlorophenyl)sulfonyl]-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methyl}-N,N-dimethylamine

H025-3072C Screening compound: N-{[3-[(3-chlorophenyl)sulfonyl]-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methyl}-N,N-dimethylamine
H025-3072C Screening compound: N-{[3-[(3-chlorophenyl)sulfonyl]-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methyl}-N,N-dimethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound H025-3072C
N-{[3-[(3-chlorophenyl)sulfonyl]-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methyl}-N,N-dimethylamine

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

H025-3072C

Molecular Formula

C18H21ClN4O2S2 (C18 H21 ClN4 O2 S2)

Compound Name

N-{[3-[(3-chlorophenyl)sulfonyl]-5,7-dimethyl-2-(methylsulfanyl)pyrazolo[1,5-a]pyrimidin-6-yl]methyl}-N,N-dimethylamine

IUPAC name

{[3-(3-chlorobenzenesulfonyl)-57-dimethyl-2-(methylsulfanyl)pyrazolo[15-a]pyrimidin-6-yl]methyl}dimethylamine

SMILES

Cc(n1nc2SC)c(CN(C)C)c(C)nc1c2S(c1cccc(Cl)c1)(=O)=O

InChI

InChI=1S/C18H21ClN4O2S2/c1-11-15(10-22(3)4)12(2)23-17(20-11)16(18(21-23)26-5)27(24,25)14-8-6-7-13(19)9-14/h6-9H,10H2,1-5H3

InChI Key

YNFRNMITWARANB-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

424.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.783

Distribution Coefficient, logD

1.723

Water Solubility, LogSw

-3.44

Polar Surface Area

54.058

Acid Dissociation Constant (pKa)

25.32

Base Dissociation Constant (pKb)

8.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

H025-3072C 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 H025-3072C chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H025-3072C?
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What is the minimum amount of H025-3072C you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H025-3072C
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H025-3072C
  • 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 H025-3072C available by request