1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione
TL;DR: 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione (CAS 799779-96-7) is a chemical compound with molecular formula C15H14Cl2N4S and molecular weight 352.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione
Also Known As: 1-(2,5-dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione, 1-(2,5-dichlorophenyl)-5-(3-pyridinylmethyl)-1,3,5-triazinane-2-thione, 1-(2,5-DICHLOROPHENYL)-5-(3-PYRIDYLMETHYL)-1,3,5-TRIAZINANE-2-THIONE
| Molecular Formula | C15H14Cl2N4S |
|---|---|
| Molecular Weight | 352.03 g/mol |
| LogP | 3.5001 |
| Topological Polar Surface Area | 31.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.03162 |
| Heavy Atoms | 22 |
| Complexity | 680.4976 |
Chemical Identifiers
| CAS Number | 799779-96-7 |
|---|---|
| SMILES | C1NC(=S)N(CN1CC2=CN=CC=C2)C3=C(C=CC(=C3)Cl)Cl |
Product Overview
1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione (CAS 799779-96-7), with molecular formula C15H14Cl2N4S and molecular weight 352.03 g/mol. IUPAC: 1-(2,5-dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione.
Chemical Property Profile of 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione
Property Insights of 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione
The XLogP value of 3.5001 indicates that 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-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 31.4 Ų, 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione has 1 hydrogen bond donor(s) and 3 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-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione?
The CAS number of 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione is 799779-96-7.
What is the molecular formula of 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione?
The molecular formula of 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione is C15H14Cl2N4S.
What is the molecular weight of 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione?
The molecular weight of 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione is 352.03 g/mol.
Where can I buy 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione?
You can request a quote for 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-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-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5-Dichlorophenyl)-5-(pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.