N-(triazol-1-yl)benzamide
TL;DR: N-(triazol-1-yl)benzamide (CAS 342785-77-7) is a chemical compound with molecular formula C9H8N4O and molecular weight 188.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(triazol-1-yl)benzamide
Also Known As: N-(triazol-1-yl)benzamide, N-(1H-1,2,3-Triazol-1-yl)benzamide, Benzamide,N-1H-1,2,3-triazol-1-yl-, Benzamide,N-1H-1,2,3-triazol-1-yl, BENZAMIDE, N-1H-1,2,3-TRIAZOL-1-YL-
| Molecular Formula | C9H8N4O |
|---|---|
| Molecular Weight | 188.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.06981 |
| Heavy Atoms | 14 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 342785-77-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NN2C=CN=N2 |
| InChIKey | XKLOEIDPEAHPEZ-UHFFFAOYSA-N |
Product Overview
N-(triazol-1-yl)benzamide (CAS 342785-77-7), with molecular formula C9H8N4O and molecular weight 188.07 g/mol. IUPAC: N-(triazol-1-yl)benzamide.
Chemical Property Profile of N-(triazol-1-yl)benzamide
Property Insights of N-(triazol-1-yl)benzamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(triazol-1-yl)benzamide. With a topological polar surface area (TPSA) of 59.8 Ų, N-(triazol-1-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(triazol-1-yl)benzamide has 1 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-(triazol-1-yl)benzamide?
The CAS number of N-(triazol-1-yl)benzamide is 342785-77-7.
What is the molecular formula of N-(triazol-1-yl)benzamide?
The molecular formula of N-(triazol-1-yl)benzamide is C9H8N4O.
What is the molecular weight of N-(triazol-1-yl)benzamide?
The molecular weight of N-(triazol-1-yl)benzamide is 188.07 g/mol.
Where can I buy N-(triazol-1-yl)benzamide?
You can request a quote for N-(triazol-1-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(triazol-1-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(triazol-1-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.