pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate
TL;DR: pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate (CAS 6457-73-4) is a chemical compound with molecular formula C16H18N2O5 and molecular weight 318.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate
Also Known As: pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate, (Pyridin-3-yl)methyl (3,4,5-trimethoxyphenyl)carbamate
| Molecular Formula | C16H18N2O5 |
|---|---|
| Molecular Weight | 318.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 318.12158 |
| Heavy Atoms | 23 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 6457-73-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)NC(=O)OCC2=CN=CC=C2 |
| InChIKey | WTGDBSXSPDJBBN-UHFFFAOYSA-N |
Product Overview
pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate (CAS 6457-73-4), with molecular formula C16H18N2O5 and molecular weight 318.12 g/mol. IUPAC: pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate.
Chemical Property Profile of pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate
Property Insights of pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate. Following Lipinski's Rule of Five, pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate has 1 hydrogen bond donor(s) and 6 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 pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate?
The CAS number of pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate is 6457-73-4.
What is the molecular formula of pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate?
The molecular formula of pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate is C16H18N2O5.
What is the molecular weight of pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate?
The molecular weight of pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate is 318.12 g/mol.
Where can I buy pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate?
You can request a quote for pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for pyridin-3-ylmethyl N-(3,4,5-trimethoxyphenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.