![6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine structure](/static/products/588/58848-67-2.png)
6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine
TL;DR: 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine (CAS 58848-67-2) is a chemical compound with molecular formula C10H10ClN5 and molecular weight 235.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-chloro-4-methylphenyl)-1,2,4-triazine-3,5-diamine
Also Known As: 6-(3-Chloro-4-methylphenyl)-1,2,4-triazine-3,5-diamine, 1,2,4-Triazine-3,5-diamine, 6-(3-chloro-4-methylphenyl)-, 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine, 6-(3-Chloro-4-methylphenyl)-1,2,4-triazine-3,5-diamine #
| Molecular Formula | C10H10ClN5 |
|---|---|
| Molecular Weight | 235.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.06247 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 58848-67-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=C(N=C(N=N2)N)N)Cl |
| InChIKey | IIYQTAFKARMCJS-UHFFFAOYSA-N |
Product Overview
6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine (CAS 58848-67-2), with molecular formula C10H10ClN5 and molecular weight 235.06 g/mol. IUPAC: 6-(3-chloro-4-methylphenyl)-1,2,4-triazine-3,5-diamine.
Chemical Property Profile of 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine
Property Insights of 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine. Following Lipinski's Rule of Five, 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine has 2 hydrogen bond donor(s) and 5 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-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine?
The CAS number of 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine is 58848-67-2.
What is the molecular formula of 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine?
The molecular formula of 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine is C10H10ClN5.
What is the molecular weight of 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine?
The molecular weight of 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine is 235.06 g/mol.
Where can I buy 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine?
You can request a quote for 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 6-[4-Methyl-3-chlorophenyl]-3,5-diamino-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.