3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione
TL;DR: 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione (CAS 450352-40-6) is a chemical compound with molecular formula C16H23N3OS2 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione
Also Known As: ChemDiv3_012925, 3-benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione, BRD-K95762625-001-01-9, 3-benzyl-5-[2-(morpholin-4-yl)ethyl]-1,3,5-thiadiazinane-2-thione, 3-benzyl-5-(2-morpholinoethyl)-1,3,5-thiadiazinane-2-thione
| Molecular Formula | C16H23N3OS2 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 2.0695 |
| Topological Polar Surface Area | 18.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.12827 |
| Heavy Atoms | 22 |
| Complexity | 479.5391 |
Chemical Identifiers
| CAS Number | 450352-40-6 |
|---|---|
| SMILES | C1COCCN1CCN2CN(C(=S)SC2)CC3=CC=CC=C3 |
Product Overview
3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione (CAS 450352-40-6), with molecular formula C16H23N3OS2 and molecular weight 337.13 g/mol. IUPAC: 3-benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione.
Chemical Property Profile of 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione
Property Insights of 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione
The XLogP value of 2.0695 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione. With a topological polar surface area (TPSA) of 18.95 Ų, 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione has 0 hydrogen bond donor(s) and 5 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 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione?
The CAS number of 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione is 450352-40-6.
What is the molecular formula of 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione?
The molecular formula of 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione is C16H23N3OS2.
What is the molecular weight of 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione?
The molecular weight of 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione is 337.13 g/mol.
Where can I buy 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione?
You can request a quote for 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-5-(2-morpholin-4-ylethyl)-1,3,5-thiadiazinane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.