5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid
TL;DR: 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid (CAS 50533-72-7) is a chemical compound with molecular formula C10H16N5O4P and molecular weight 301.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid
Also Known As: 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid, 5-(aminomethyl)-3-benzyltriazol-4-amine; phosphoric acid, 1H-1,2,3-Triazole-4-methanamine, 5-amino-1-(phenylmethyl)-, phosphate- (2:1, 1H-1,3-Triazole-4-methanamine, 5-amino-1-(phenylmethyl)-, phosphate- (2:1), phosphoric acid compound with 4-(aminomethyl)-1-benzyl-1H-1,2,3-triazol-5-amine (1:1)
| Molecular Formula | C10H16N5O4P |
|---|---|
| Molecular Weight | 301.09 g/mol |
| LogP | -0.5613 |
| Topological Polar Surface Area | 160.51 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.094 |
| Heavy Atoms | 20 |
| Complexity | 574.32416 |
Chemical Identifiers
| CAS Number | 50533-72-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=C(N=N2)CN)N.OP(=O)(O)O |
Product Overview
5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid (CAS 50533-72-7), with molecular formula C10H16N5O4P and molecular weight 301.09 g/mol. IUPAC: 5-(aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid.
Chemical Property Profile of 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid
Property Insights of 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid
The XLogP value of -0.5613 indicates that 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.51 Ų indicates high polarity, suggesting 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid has 5 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 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid?
The CAS number of 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid is 50533-72-7.
What is the molecular formula of 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid?
The molecular formula of 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid is C10H16N5O4P.
What is the molecular weight of 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid?
The molecular weight of 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid is 301.09 g/mol.
Where can I buy 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid?
You can request a quote for 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(Aminomethyl)-3-benzyltriazol-4-amine;phosphoric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.