Vanitiolide
TL;DR: Vanitiolide (CAS 17692-71-6) is a chemical compound with molecular formula C12H15NO3S and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxy-3-methoxyphenyl)-morpholin-4-ylmethanethione
Also Known As: Vanitiolide, Vanitiolid, Bildux, Vanitiolida, Vanitiolidum
| Molecular Formula | C12H15NO3S |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.07727 |
| Heavy Atoms | 17 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 17692-71-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(=S)N2CCOCC2)O |
| InChIKey | WQYRHRAZNNRDIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vanitiolide (CAS 17692-71-6), with molecular formula C12H15NO3S and molecular weight 253.08 g/mol. IUPAC: (4-hydroxy-3-methoxyphenyl)-morpholin-4-ylmethanethione.
Chemical Property Profile of Vanitiolide
Property Insights of Vanitiolide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vanitiolide. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Vanitiolide. Following Lipinski's Rule of Five, Vanitiolide has 1 hydrogen bond donor(s) and 4 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 Vanitiolide?
The CAS number of Vanitiolide is 17692-71-6.
What is the molecular formula of Vanitiolide?
The molecular formula of Vanitiolide is C12H15NO3S.
What is the molecular weight of Vanitiolide?
The molecular weight of Vanitiolide is 253.08 g/mol.
Where can I buy Vanitiolide?
You can request a quote for Vanitiolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vanitiolide?
Yes, KEHONG BIO provides custom synthesis services for Vanitiolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.