C16H16N2O6S2
TL;DR: C16H16N2O6S2 (CAS 67801-09-6) is a chemical compound with molecular formula C16H16N2O6S2 and molecular weight 396.04498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[5-[1-(3-methyl-1,3-benzoxazol-2-ylidene)propan-2-ylidene]-4-oxo-2-sulfanylidene-1,3-oxazolidin-3-yl]ethanesulfonic acid
Also Known As: 3-Oxazolidineethanesulfonic acid, 5-[1-methyl-2-(3-methyl-2(3H)-benzoxazolylidene)ethylidene]-4-oxo-2-thioxo-, 2-{5-[1-(3-Methyl-1,3-benzoxazol-2(3H)-ylidene)propan-2-ylidene]-4-oxo-2-sulfanylidene-1,3-oxazolidin-3-yl}ethane-1-sulfonic acid, 3-(2-Sulfoethyl)-5-((3-methyl-2-benzoxazolylidene)isopropylidenyl)-2-thioxo-4-oxazolidinone, 3-Oxazolidineethanesulfonic acid, 5-(1-methyl-2-(3-methyl-2(3H)-benzoxazolylidene)ethylidene)-4-oxo-2-thioxo-, 5-[1-Methyl-2-(3-methyl-2(3H)-benzoxazol-1-ylidene)ethylidene]-4-oxo-2-thioxo-3-oxazolidineethanesulfonic acid
Technical Specifications
| Molecular Formula | C16H16N2O6S2 |
| Molecular Weight | 396.04498 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 137.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.04498 Da |
| Heavy Atoms | 26 |
| Complexity | 783.0 |
| SMILES | CC(=C1C(=O)N(C(=S)O1)CCS(=O)(=O)O)C=C2N(C3=CC=CC=C3O2)C |
| InChIKey | WALBVDGKOSRRIN-UHFFFAOYSA-N |
Chemical Property Profile of C16H16N2O6S2
Property Insights of C16H16N2O6S2
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C16H16N2O6S2. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C16H16N2O6S2. Following Lipinski's Rule of Five, C16H16N2O6S2 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C16H16N2O6S2?
The CAS number of C16H16N2O6S2 is 67801-09-6.
What is the molecular formula of C16H16N2O6S2?
The molecular formula of C16H16N2O6S2 is C16H16N2O6S2.
What is the molecular weight of C16H16N2O6S2?
The molecular weight of C16H16N2O6S2 is 396.04498 g/mol.
Where can I buy C16H16N2O6S2?
You can request a quote for C16H16N2O6S2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C16H16N2O6S2?
Yes, CoreyChem provides custom synthesis services for C16H16N2O6S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.