G788-0098 Screening compound: 2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[2-(4-methylphenyl)ethyl]acetamide

G788-0098 Screening compound: 2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[2-(4-methylphenyl)ethyl]acetamide
G788-0098 Screening compound: 2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[2-(4-methylphenyl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G788-0098
2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[2-(4-methylphenyl)ethyl]acetamide

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

G788-0098

Molecular Formula

C26H28N4O3S (C26 H28 N4 O3 S)

Compound Name

2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[2-(4-methylphenyl)ethyl]acetamide

IUPAC name

2-{[3-(34-dimethoxyphenyl)-5-methylpyrazolo[15-a]pyrimidin-7-yl]sulfanyl}-N-[2-(4-methylphenyl)ethyl]acetamide

SMILES

Cc1ccc(CCNC(CSc(n2nc3)cc(C)nc2c3-c(cc2)cc(OC)c2OC)=O)cc1

InChI

InChI=1S/C26H28N4O3S/c1-17-5-7-19(8-6-17)11-12-27-24(31)16-34-25-13-18(2)29-26-21(15-28-30(25)26)20-9-10-22(32-3)23(14-20)33-4/h5-10,13-15H,11-12,16H2,1-4H3,(H,27,31)

InChI Key

YXGZVRUTSFHHRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27157882

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.6

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.816

Distribution Coefficient, logD

3.810

Water Solubility, LogSw

-3.75

Polar Surface Area

59.497

Acid Dissociation Constant (pKa)

14.61

Base Dissociation Constant (pKb)

5.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with G788-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G788-0098?
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What is the minimum amount of G788-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G788-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G788-0098
  • 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 G788-0098 available by request