F835-0579 Screening compound: 7-({[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one
Chemical Structure Depiction of ChemDiv screening compound F835-0579
7-({[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-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
F835-0579
Molecular Formula
C18H11ClN6O2S2 (C18 H11 ClN6 O2 S2)
Compound Name
7-({[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one
IUPAC name
7-({[3-(2-chlorophenyl)-124-oxadiazol-5-yl]methyl}sulfanyl)-2-(thiophen-2-yl)-4H5H-pyrazolo[15-d][124]triazin-4-one
SMILES
O=C(c1cc(-c2cccs2)nn11)NN=C1SCc1nc(-c(cccc2)c2Cl)no1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
442.91
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.466
Distribution Coefficient, logD
4.464
Water Solubility, LogSw
-4.56
Polar Surface Area
83.676
Acid Dissociation Constant (pKa)
9.83
Base Dissociation Constant (pKb)
2.72
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
5.60
F835-0579 in Drug Discovery
Included in Screening Libraries
KRAS-Targeted Library (16000 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Kinases
References: we are preparing a list of scientific research reports with F835-0579 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)