G199-1015 Screening compound: 4-{[3-(2,3-dimethylphenoxy)propyl]sulfanyl}-2-(2-fluorophenyl)-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-7-one

G199-1015 Screening compound: 4-{[3-(2,3-dimethylphenoxy)propyl]sulfanyl}-2-(2-fluorophenyl)-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-7-one
G199-1015 Screening compound: 4-{[3-(2,3-dimethylphenoxy)propyl]sulfanyl}-2-(2-fluorophenyl)-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G199-1015
4-{[3-(2,3-dimethylphenoxy)propyl]sulfanyl}-2-(2-fluorophenyl)-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-7-one

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

G199-1015

Molecular Formula

C22H21FN4O2S (C22 H21 FN4 O2 S)

Compound Name

4-{[3-(2,3-dimethylphenoxy)propyl]sulfanyl}-2-(2-fluorophenyl)-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-7-one

IUPAC name

4-{[3-(23-dimethylphenoxy)propyl]sulfanyl}-2-(2-fluorophenyl)-6H7H-pyrazolo[15-a][135]triazin-7-one

SMILES

Cc1cccc(OCCCSC(N2N3)=NC(c(cccc4)c4F)=NC2=CC3=O)c1C

InChI

InChI=1S/C22H21FN4O2S/c1-14-7-5-10-18(15(14)2)29-11-6-12-30-22-25-21(16-8-3-4-9-17(16)23)24-19-13-20(28)26-27(19)22/h3-5,7-10,13H,6,11-12H2,1-2H3,(H,26,28)

InChI Key

MPMZZTZKMFQGJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14984636

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.616

Distribution Coefficient, logD

4.616

Water Solubility, LogSw

-4.51

Polar Surface Area

57.437

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with G199-1015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G199-1015?
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What is the minimum amount of G199-1015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G199-1015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G199-1015
  • 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 G199-1015 available by request