N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide
TL;DR: N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide (CAS 68070-55-3) 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.
N-naphthalen-1-yl-1H-1,2,4-triazole-5-carboxamide
Also Known As: N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide, 1H-1,2,4-triazol-3-yl-N-naphthylcarboxamide, N-(1-naphthyl)-1H-1,2,4-triazole-3-carboxamide, N-naphthalen-1-yl-1H-1,2,4-triazole-5-carboxamide, A1997/0083894
| Molecular Formula | C13H10N4O |
|---|---|
| Molecular Weight | 238.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 70.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.08546 |
| Heavy Atoms | 18 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 68070-55-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=NC=NN3 |
| InChIKey | UKIDZQRONWMWCG-UHFFFAOYSA-N |
Product Overview
N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide (CAS 68070-55-3), with molecular formula C13H10N4O and molecular weight 238.09 g/mol. IUPAC: N-naphthalen-1-yl-1H-1,2,4-triazole-5-carboxamide.
Chemical Property Profile of N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide
Property Insights of N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide. Following Lipinski's Rule of Five, N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide has 2 hydrogen bond donor(s) and 3 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-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide?
The CAS number of N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide is 68070-55-3.
What is the molecular formula of N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide?
The molecular formula of N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide is C13H10N4O.
What is the molecular weight of N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide?
The molecular weight of N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide is 238.09 g/mol.
Where can I buy N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide?
You can request a quote for N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(naphthalen-1-yl)-1H-1,2,4-triazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.