(3aR,6aS)-hexahydro-1H-5
TL;DR: (3aR,6aS)-hexahydro-1H-5 (CAS 1903872-85-4) is a chemical compound with molecular formula C6H9NO3S and molecular weight 175.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,6aS)-5,5-dioxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-b]pyrrol-2-one
Also Known As: (3aR,6aS)-hexahydro-1H-5, (3aR,6aS)-hexahydro-1H-5, E?-thieno[3,4-b]pyrrole-2,5,5-trione, Rel-(3aR,6aS)-tetrahydro-1H-thieno[3,4-b]pyrrol-2(3H)-one 5,5-dioxide
| Molecular Formula | C6H9NO3S |
|---|---|
| Molecular Weight | 175.03 g/mol |
| LogP | -1.0805 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.03032 |
| Heavy Atoms | 11 |
| Complexity | 272.94925 |
Chemical Identifiers
| CAS Number | 1903872-85-4 |
|---|---|
| SMILES | C1[C@H]2CS(=O)(=O)C[C@H]2NC1=O |
Product Overview
(3aR,6aS)-hexahydro-1H-5 (CAS 1903872-85-4), with molecular formula C6H9NO3S and molecular weight 175.03 g/mol. IUPAC: (3aR,6aS)-5,5-dioxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-b]pyrrol-2-one.
Chemical Property Profile of (3aR,6aS)-hexahydro-1H-5
Property Insights of (3aR,6aS)-hexahydro-1H-5
The XLogP value of -1.0805 indicates that (3aR,6aS)-hexahydro-1H-5 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for (3aR,6aS)-hexahydro-1H-5. Following Lipinski's Rule of Five, (3aR,6aS)-hexahydro-1H-5 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 (3aR,6aS)-hexahydro-1H-5?
The CAS number of (3aR,6aS)-hexahydro-1H-5 is 1903872-85-4.
What is the molecular formula of (3aR,6aS)-hexahydro-1H-5?
The molecular formula of (3aR,6aS)-hexahydro-1H-5 is C6H9NO3S.
What is the molecular weight of (3aR,6aS)-hexahydro-1H-5?
The molecular weight of (3aR,6aS)-hexahydro-1H-5 is 175.03 g/mol.
Where can I buy (3aR,6aS)-hexahydro-1H-5?
You can request a quote for (3aR,6aS)-hexahydro-1H-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aR,6aS)-hexahydro-1H-5?
Yes, KEHONG BIO provides custom synthesis services for (3aR,6aS)-hexahydro-1H-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.