N-Nitrosoatrazine
TL;DR: N-Nitrosoatrazine (CAS 56525-09-8) is a chemical compound with molecular formula C8H13ClN6O and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-N-ethylnitrous amide
Also Known As: N-Nitrosoatrazine, Nitrosoatrazine, Nitorosoatrazine, N-[4-chloro-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-N-ethylnitrous amide, 6-Chloro-N-ethyl-N'-(1-methylethyl)-N-nitroso-1,3,5-triazine-2,4-diamine
| Molecular Formula | C8H13ClN6O |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.08394 |
| Heavy Atoms | 16 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 56525-09-8 |
|---|---|
| SMILES | CCN(C1=NC(=NC(=N1)NC(C)C)Cl)N=O |
| InChIKey | WQSMQGITEZLGKF-UHFFFAOYSA-N |
Product Overview
N-Nitrosoatrazine (CAS 56525-09-8), with molecular formula C8H13ClN6O and molecular weight 244.08 g/mol. IUPAC: N-[4-chloro-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-N-ethylnitrous amide.
Chemical Property Profile of N-Nitrosoatrazine
Property Insights of N-Nitrosoatrazine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitrosoatrazine. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Nitrosoatrazine. Following Lipinski's Rule of Five, N-Nitrosoatrazine 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 N-Nitrosoatrazine?
The CAS number of N-Nitrosoatrazine is 56525-09-8.
What is the molecular formula of N-Nitrosoatrazine?
The molecular formula of N-Nitrosoatrazine is C8H13ClN6O.
What is the molecular weight of N-Nitrosoatrazine?
The molecular weight of N-Nitrosoatrazine is 244.08 g/mol.
Where can I buy N-Nitrosoatrazine?
You can request a quote for N-Nitrosoatrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nitrosoatrazine?
Yes, KEHONG BIO provides custom synthesis services for N-Nitrosoatrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.