6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one
TL;DR: 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one (CAS 104809-12-3) is a chemical compound with molecular formula C7H10N2O2S and molecular weight 186.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-2-methyl-3-sulfanylidene-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one
Also Known As: MTH-DL-Hydroxyproline, 6-hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one, 7-hydroxy-3-methyl-2-sulfanylidene-1,3-diazabicyclo[3.3.0]octan-4-one, 6-hydroxy-2-methyl-3-sulfanylidene-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one, 6-hydroxy-2-methyl-3-sulfanylidene-hexahydro-1H-pyrrolo[1,2-c]imidazolidin-1-one
| Molecular Formula | C7H10N2O2S |
|---|---|
| Molecular Weight | 186.05 g/mol |
| LogP | -0.8215 |
| Topological Polar Surface Area | 43.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.0463 |
| Heavy Atoms | 12 |
| Complexity | 231.79092 |
Chemical Identifiers
| CAS Number | 104809-12-3 |
|---|---|
| SMILES | CN1C(=O)C2CC(CN2C1=S)O |
Product Overview
6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one (CAS 104809-12-3), with molecular formula C7H10N2O2S and molecular weight 186.05 g/mol. IUPAC: 6-hydroxy-2-methyl-3-sulfanylidene-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one.
Chemical Property Profile of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one
Property Insights of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one
The XLogP value of -0.8215 indicates that 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.78 Ų, 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one?
The CAS number of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one is 104809-12-3.
What is the molecular formula of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one?
The molecular formula of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one is C7H10N2O2S.
What is the molecular weight of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one?
The molecular weight of 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one is 186.05 g/mol.
Where can I buy 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one?
You can request a quote for 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-2-methyl-3-thioxo-2,5,6,7,7a-pentahydro-2-azapyrrolizin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.