M114-1437 Screening compound: methyl 2-[(8-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]acetate
Chemical Structure Depiction of ChemDiv screening compound M114-1437
methyl 2-[(8-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]acetate
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
M114-1437
Molecular Formula
C19H20FN5O4S2 (C19 H20 FN5 O4 S2)
Compound Name
methyl 2-[(8-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]acetate
IUPAC name
methyl 2-[(8-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-[124]triazolo[43-a]pyridin-3-yl)sulfanyl]acetate
SMILES
COC(CSc1nnc2n1cccc2S(N(CC1)CCN1c(cc1)ccc1F)(=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
465.53
Hydrogen Bond Acceptors Count
11.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
1.544
Distribution Coefficient, logD
1.544
Water Solubility, LogSw
-2.11
Polar Surface Area
78.527
Acid Dissociation Constant (pKa)
18.55
Base Dissociation Constant (pKb)
2.41
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
31.60
M114-1437 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
SmartTM Library (51161 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with M114-1437 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)