C430-0461 Screening compound: 2-(phenylsulfanyl)acetic acid
Chemical Structure Depiction of ChemDiv screening compound C430-0461
2-(phenylsulfanyl)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
C430-0461
Molecular Formula
C8H8O2S (C8 H8 O2 S)
Compound Name
2-(phenylsulfanyl)acetic acid
IUPAC name
2-(phenylsulfanyl)acetic acid
SMILES
OC(CSc1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
168.22
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
2
Partition Coefficient, logP
1.411
Distribution Coefficient, logD
-2.075
Water Solubility, LogSw
-1.78
Polar Surface Area
28.622
Acid Dissociation Constant (pKa)
3.91
Base Dissociation Constant (pKb)
0.00
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
12.50
C430-0461 in Drug Discovery
Included in Screening Libraries
Cardiovascular Library (22201 compounds)
Dark Chemical Matter Library (18430 compounds)
STING Agonist Library (5895 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Cancer
- Immune system
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Cancer
- Digestive system
- Nervous system
- Female
- Metabolic
- Endocrine
- Pool
- Others
- Phosphatases
- Phosphatases
- Receptor's ligands
References: we are preparing a list of scientific research reports with C430-0461 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)