1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol
TL;DR: 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol (CAS 169828-29-9) is a chemical compound with molecular formula C13H10N4O and molecular weight 238.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol
Also Known As: 1-[(E)-(1H-1,2,4-Triazol-3-ylimino)methyl]-2-naphthol
| Molecular Formula | C13H10N4O |
|---|---|
| Molecular Weight | 238.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.08546 |
| Heavy Atoms | 18 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 169828-29-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C=NC3=NC=NN3)O |
| InChIKey | HCHVIHWGGJUZHW-UHFFFAOYSA-N |
Product Overview
1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol (CAS 169828-29-9), with molecular formula C13H10N4O and molecular weight 238.09 g/mol. IUPAC: 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol.
Chemical Property Profile of 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol
Property Insights of 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol. Following Lipinski's Rule of Five, 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol has 2 hydrogen bond donor(s) and 4 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 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol?
The CAS number of 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol is 169828-29-9.
What is the molecular formula of 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol?
The molecular formula of 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol is C13H10N4O.
What is the molecular weight of 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol?
The molecular weight of 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol is 238.09 g/mol.
Where can I buy 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol?
You can request a quote for 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-1,2,4-triazol-5-yliminomethyl)naphthalen-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.