![3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine structure](/static/products/588/58848-65-0.png)
3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine
TL;DR: 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine (CAS 58848-65-0) is a chemical compound with molecular formula C10H9N5O2 and molecular weight 231.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1,3-benzodioxol-5-yl)-1,2,4-triazine-3,5-diamine
Also Known As: 6-(1,3-Benzodioxol-5-yl)-1,2,4-triazine-3,5-diamine, 1,2,4-Triazine-3,5-diamine, 6-(1,3-benzodioxol-5-yl)-, 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine, 6-(1,3-Benzodioxol-5-yl)-1,2,4-triazine-3,5-diamine #
| Molecular Formula | C10H9N5O2 |
|---|---|
| Molecular Weight | 231.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.07562 |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 58848-65-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=C(N=C(N=N3)N)N |
| InChIKey | GMJXWZKVYNLKDD-UHFFFAOYSA-N |
Product Overview
3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine (CAS 58848-65-0), with molecular formula C10H9N5O2 and molecular weight 231.08 g/mol. IUPAC: 6-(1,3-benzodioxol-5-yl)-1,2,4-triazine-3,5-diamine.
Chemical Property Profile of 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine
Property Insights of 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine. Following Lipinski's Rule of Five, 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine has 2 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 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine?
The CAS number of 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine is 58848-65-0.
What is the molecular formula of 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine?
The molecular formula of 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine is C10H9N5O2.
What is the molecular weight of 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine?
The molecular weight of 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine is 231.08 g/mol.
Where can I buy 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine?
You can request a quote for 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-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 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Diamino-6-[3,4-methylenedioxyphenyl]-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.