4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-
TL;DR: 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- (CAS 25952-36-7) is a chemical compound with molecular formula C7H14N2OS and molecular weight 174.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-diethyl-1,3,5-oxadiazinane-4-thione
Also Known As: 3,5-diethyl-1,3,5-oxadiazinane-4-thione, 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-, Tetrahydro-3,5-diethyl-4H-1,3,5-oxadiazine-4-thione, 3,5-Diethyltetrahydro-4H-1,3,5-oxadiazine-4-thione, RefChem:527306
| Molecular Formula | C7H14N2OS |
|---|---|
| Molecular Weight | 174.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 47.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.08269 |
| Heavy Atoms | 11 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 25952-36-7 |
|---|---|
| SMILES | CCN1COCN(C1=S)CC |
| InChIKey | FIVLVWFESUJJRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- (CAS 25952-36-7), with molecular formula C7H14N2OS and molecular weight 174.08 g/mol. IUPAC: 3,5-diethyl-1,3,5-oxadiazinane-4-thione.
Chemical Property Profile of 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-
Property Insights of 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-. With a topological polar surface area (TPSA) of 47.8 Ų, 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- has 0 hydrogen bond donor(s) and 2 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 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-?
The CAS number of 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- is 25952-36-7.
What is the molecular formula of 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-?
The molecular formula of 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- is C7H14N2OS.
What is the molecular weight of 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-?
The molecular weight of 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- is 174.08 g/mol.
Where can I buy 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-?
You can request a quote for 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1,3,5-Oxadiazine-4-thione, 3,5-diethyltetrahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.