G199-1080 Screening compound: 2-{[2-(3-fluorophenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide

G199-1080 Screening compound: 2-{[2-(3-fluorophenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
G199-1080 Screening compound: 2-{[2-(3-fluorophenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G199-1080
2-{[2-(3-fluorophenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxyphenyl)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

G199-1080

Molecular Formula

C20H16FN5O3S (C20 H16 FN5 O3 S)

Compound Name

2-{[2-(3-fluorophenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide

IUPAC name

2-{[2-(3-fluorophenyl)-7-oxo-6H7H-pyrazolo[15-a][135]triazin-4-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide

SMILES

COc(cccc1)c1NC(CSC(N1N2)=NC(c3cc(F)ccc3)=NC1=CC2=O)=O

InChI

InChI=1S/C20H16FN5O3S/c1-29-15-8-3-2-7-14(15)22-18(28)11-30-20-24-19(12-5-4-6-13(21)9-12)23-16-10-17(27)25-26(16)20/h2-10H,11H2,1H3,(H,22,28)(H,25,27)

InChI Key

INOJRMPAMPSTGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14984649

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.573

Distribution Coefficient, logD

2.573

Water Solubility, LogSw

-3.06

Polar Surface Area

80.015

Acid Dissociation Constant (pKa)

11.57

Base Dissociation Constant (pKb)

2.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with G199-1080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G199-1080?
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What is the minimum amount of G199-1080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G199-1080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G199-1080
  • 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 G199-1080 available by request