BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-
TL;DR: BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- (CAS 76217-33-9) is a chemical compound with molecular formula C16H13N3O2 and molecular weight 279.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-methoxyphenyl)-1,2,4-triazol-1-yl]benzaldehyde
Also Known As: 2-(3-(3-Methoxyphenyl)-s-triazol-5-yl)benzaldehyde, BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-, o-(5-(m-Methoxyphenyl)-s-triazol-3-yl)benzaldehyde, 2-[3-(3-methoxyphenyl)-1,2,4-triazol-1-yl]benzaldehyde, Benzaldehyde, 2-(5-(3-methoxyphenyl)-1H-1,2,4-triazol-3-yl)-
| Molecular Formula | C16H13N3O2 |
|---|---|
| Molecular Weight | 279.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 57.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.10077 |
| Heavy Atoms | 21 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 76217-33-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=NN(C=N2)C3=CC=CC=C3C=O |
| InChIKey | OLESXLRHLYXRKZ-UHFFFAOYSA-N |
Product Overview
BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- (CAS 76217-33-9), with molecular formula C16H13N3O2 and molecular weight 279.10 g/mol. IUPAC: 2-[3-(3-methoxyphenyl)-1,2,4-triazol-1-yl]benzaldehyde.
Chemical Property Profile of BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-
Property Insights of BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-. With a topological polar surface area (TPSA) of 57.0 Ų, BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- has 0 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 BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-?
The CAS number of BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- is 76217-33-9.
What is the molecular formula of BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-?
The molecular formula of BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- is C16H13N3O2.
What is the molecular weight of BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-?
The molecular weight of BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- is 279.10 g/mol.
Where can I buy BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-?
You can request a quote for BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)-?
Yes, KEHONG BIO provides custom synthesis services for BENZALDEHYDE, o-(5-(m-METHOXYPHENYL)-s-TRIAZOL-3-YL)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.