G788-0111 Screening compound: 2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide

G788-0111 Screening compound: 2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
G788-0111 Screening compound: 2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G788-0111
2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]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

G788-0111

Molecular Formula

C24H23FN4O3S (C24 H23 FN4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc(n1nc2)SCC(NCc(cc3)ccc3F)=O)nc1c2-c(cc1)cc(OC)c1OC

InChI

InChI=1S/C24H23FN4O3S/c1-15-10-23(33-14-22(30)26-12-16-4-7-18(25)8-5-16)29-24(28-15)19(13-27-29)17-6-9-20(31-2)21(11-17)32-3/h4-11,13H,12,14H2,1-3H3,(H,26,30)

InChI Key

QYBQZTLCPJVCJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27157890

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.646

Distribution Coefficient, logD

3.641

Water Solubility, LogSw

-3.77

Polar Surface Area

59.656

Acid Dissociation Constant (pKa)

12.81

Base Dissociation Constant (pKb)

5.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

G788-0111 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with G788-0111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G788-0111?
Check Price and Availability of G788-0111, 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 G788-0111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G788-0111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G788-0111
  • 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 G788-0111 available by request