F235-1943 Screening compound: 2-{[4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Chemical Structure Depiction of ChemDiv screening compound F235-1943
2-{[4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
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
F235-1943
Molecular Formula
C16H10Cl3N3O2S (C16 H10 Cl3 N3 O2 S)
Compound Name
2-{[4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
IUPAC name
2-{[4-(4-chlorophenyl)-5-(24-dichlorophenyl)-4H-124-triazol-3-yl]sulfanyl}acetic acid
SMILES
OC(CSc1nnc(-c(ccc(Cl)c2)c2Cl)n1-c(cc1)ccc1Cl)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
414.7
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.424
Distribution Coefficient, logD
1.131
Water Solubility, LogSw
-4.52
Polar Surface Area
53.368
Acid Dissociation Constant (pKa)
4.11
Base Dissociation Constant (pKb)
2.04
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
6.30
F235-1943 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Epigenetic
References: we are preparing a list of scientific research reports with F235-1943 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)