6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine
TL;DR: 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine (CAS 73292-53-2) is a chemical compound with molecular formula C7H11ClN6O and molecular weight 230.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]-N-ethylnitrous amide
Also Known As: N-Nitroso Simazine, N-Nitrososimazine, Nitrososimazine, Hydrazine, cyclohexyl-, 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine
| Molecular Formula | C7H11ClN6O |
|---|---|
| Molecular Weight | 230.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.06828 |
| Heavy Atoms | 15 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 73292-53-2 |
|---|---|
| SMILES | CCNC1=NC(=NC(=N1)Cl)N(CC)N=O |
| InChIKey | OKVLOVNSJIXWJD-UHFFFAOYSA-N |
Product Overview
6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine (CAS 73292-53-2), with molecular formula C7H11ClN6O and molecular weight 230.07 g/mol. IUPAC: N-[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]-N-ethylnitrous amide.
Chemical Property Profile of 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine
Property Insights of 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine. Following Lipinski's Rule of Five, 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine 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 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine?
The CAS number of 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine is 73292-53-2.
What is the molecular formula of 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine?
The molecular formula of 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine is C7H11ClN6O.
What is the molecular weight of 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine?
The molecular weight of 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine is 230.07 g/mol.
Where can I buy 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine?
You can request a quote for 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-N,N'-diethyl-N-nitroso-1,3,5-triazine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.