2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate
TL;DR: 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate (CAS 328012-97-1) is a chemical compound with molecular formula C12H22N6OS2 and molecular weight 330.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate
Also Known As: 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate, 2-(6-amino-4-(diethylamino)-2-oxo-1,3,5-triazin-1(2H)-yl)ethyl dimethylcarbamodithioate, 2-[6-amino-4-(diethylamino)-2-oxo-1,3,5-triazin-1(2H)-yl]ethyl dimethylcarbamodithioate, Dimethyl-dithiocarbamic acid 2-(6-amino-4-diethylamino-2-oxo-2H-[1,3,5]triazin-1-yl)-ethyl ester
| Molecular Formula | C12H22N6OS2 |
|---|---|
| Molecular Weight | 330.13 g/mol |
| LogP | 0.6464 |
| Topological Polar Surface Area | 80.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.12964 |
| Heavy Atoms | 21 |
| Complexity | 541.0394 |
Chemical Identifiers
| CAS Number | 328012-97-1 |
|---|---|
| SMILES | CCN(CC)C1=NC(=O)N(C(=N1)N)CCSC(=S)N(C)C |
Product Overview
2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate (CAS 328012-97-1), with molecular formula C12H22N6OS2 and molecular weight 330.13 g/mol. IUPAC: 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate.
Chemical Property Profile of 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate
Property Insights of 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate
The XLogP value of 0.6464 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate. The TPSA of 80.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate. Following Lipinski's Rule of Five, 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate has 1 hydrogen bond donor(s) and 7 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 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate?
The CAS number of 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate is 328012-97-1.
What is the molecular formula of 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate?
The molecular formula of 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate is C12H22N6OS2.
What is the molecular weight of 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate?
The molecular weight of 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate is 330.13 g/mol.
Where can I buy 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate?
You can request a quote for 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-amino-4-(diethylamino)-6-oxo-1,3,5-triazin-1-yl]ethyl N,N-dimethylcarbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.