Milneb
TL;DR: Milneb (CAS 3773-49-7) is a chemical compound with molecular formula C12H22N4S4 and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Milneb
3-[2-(4,6-dimethyl-2-sulfanylidene-1,3,5-thiadiazinan-3-yl)ethyl]-4,6-dimethyl-1,3,5-thiadiazinane-2-thione
Also Known As: Milneb, Thiadiazin, Banlate, Sanipa, Thiadiazine
| Molecular Formula | C12H22N4S4 |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.07272 |
| Heavy Atoms | 20 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 3773-49-7 |
|---|---|
| SMILES | CC1NC(SC(=S)N1CCN2C(NC(SC2=S)C)C)C |
| InChIKey | JZFICWYCTCCINF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Milneb (CAS 3773-49-7), with molecular formula C12H22N4S4 and molecular weight 350.07 g/mol. IUPAC: 3-[2-(4,6-dimethyl-2-sulfanylidene-1,3,5-thiadiazinan-3-yl)ethyl]-4,6-dimethyl-1,3,5-thiadiazinane-2-thione.
Chemical Property Profile of Milneb
Property Insights of Milneb
The XLogP value of 3.1 indicates that Milneb is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting Milneb may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Milneb has 2 hydrogen bond donor(s) and 6 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 Milneb?
The CAS number of Milneb is 3773-49-7.
What is the molecular formula of Milneb?
The molecular formula of Milneb is C12H22N4S4.
What is the molecular weight of Milneb?
The molecular weight of Milneb is 350.07 g/mol.
Where can I buy Milneb?
You can request a quote for Milneb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Milneb?
Yes, KEHONG BIO provides custom synthesis services for Milneb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.