1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione
TL;DR: 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione (CAS 799786-27-9) is a chemical compound with molecular formula C18H25N3S and molecular weight 315.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-[2-(cyclohexen-1-yl)ethyl]-1,3,5-triazinane-2-thione
Also Known As: 1-benzyl-5-[2-(1-cyclohexenyl)ethyl]-1,3,5-triazinane-2-thione, 1-benzyl-5-[2-(cyclohexen-1-yl)ethyl]-1,3,5-triazinane-2-thione, 1-benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione, 1-benzyl-5-[2-(cyclohex-1-en-1-yl)ethyl]-1,3,5-triazinane-2-thione, 5-(2-cyclohex-1-enylethyl)-1-benzyl-1,3,5-triazaperhydroine-2-thione
| Molecular Formula | C18H25N3S |
|---|---|
| Molecular Weight | 315.18 g/mol |
| LogP | 3.4842 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.1769 |
| Heavy Atoms | 22 |
| Complexity | 526.3936 |
Chemical Identifiers
| CAS Number | 799786-27-9 |
|---|---|
| SMILES | C1CCC(=CC1)CCN2CNC(=S)N(C2)CC3=CC=CC=C3 |
Product Overview
1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione (CAS 799786-27-9), with molecular formula C18H25N3S and molecular weight 315.18 g/mol. IUPAC: 1-benzyl-5-[2-(cyclohexen-1-yl)ethyl]-1,3,5-triazinane-2-thione.
Chemical Property Profile of 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione
Property Insights of 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione
The XLogP value of 3.4842 indicates that 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.51 Ų, 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione has 1 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 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione?
The CAS number of 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione is 799786-27-9.
What is the molecular formula of 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione?
The molecular formula of 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione is C18H25N3S.
What is the molecular weight of 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione?
The molecular weight of 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione is 315.18 g/mol.
Where can I buy 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione?
You can request a quote for 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-5-(2-(cyclohex-1-en-1-yl)ethyl)-1,3,5-triazinane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.