![dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate structure](/static/products/4778/477871-84-4.webp)
dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate
TL;DR: dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate (CAS 477871-84-4) is a chemical compound with molecular formula C16H17N3O6 and molecular weight 347.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[1-(4-methoxyphenyl)triazole-4-carbonyl]butanedioate
Also Known As: dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate, dimethyl 2-[1-(4-methoxyphenyl)triazole-4-carbonyl]butanedioate, 1R-0811, 1,4-dimethyl 2-[1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carbonyl]butanedioate, 1,4-dimethyl 2-[1-(4-methoxyphenyl)-1,2,3-triazole-4-carbonyl]butanedioate
| Molecular Formula | C16H17N3O6 |
|---|---|
| Molecular Weight | 347.11 g/mol |
| LogP | 0.8109 |
| Topological Polar Surface Area | 109.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.11172 |
| Heavy Atoms | 25 |
| Complexity | 768.4322 |
Chemical Identifiers
| CAS Number | 477871-84-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C=C(N=N2)C(=O)C(CC(=O)OC)C(=O)OC |
Product Overview
dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate (CAS 477871-84-4), with molecular formula C16H17N3O6 and molecular weight 347.11 g/mol. IUPAC: dimethyl 2-[1-(4-methoxyphenyl)triazole-4-carbonyl]butanedioate.
Chemical Property Profile of dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate
Property Insights of dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate
The XLogP value of 0.8109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate. The TPSA of 109.61 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate. Following Lipinski's Rule of Five, dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate has 0 hydrogen bond donor(s) and 8 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 dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate?
The CAS number of dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate is 477871-84-4.
What is the molecular formula of dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate?
The molecular formula of dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate is C16H17N3O6.
What is the molecular weight of dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate?
The molecular weight of dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate is 347.11 g/mol.
Where can I buy dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate?
You can request a quote for dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 2-{[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}succinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.