Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-
TL;DR: Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- (CAS 104699-38-9) is a chemical compound with molecular formula C16H24N2O4 and molecular weight 308.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(azepan-1-yl)-3,4,5-trimethoxybenzamide
Also Known As: N-(azepan-1-yl)-3,4,5-trimethoxybenzamide, N-(Hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxybenzamide, BENZAMIDE, N-(HEXAHYDRO-1H-AZEPIN-1-YL)-3,4,5-TRIMETHOXY-, RefChem:322443
| Molecular Formula | C16H24N2O4 |
|---|---|
| Molecular Weight | 308.17 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 60.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.1736 |
| Heavy Atoms | 22 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 104699-38-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NN2CCCCCC2 |
| InChIKey | CWDSWKNYBILLOO-UHFFFAOYSA-N |
Product Overview
Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- (CAS 104699-38-9), with molecular formula C16H24N2O4 and molecular weight 308.17 g/mol. IUPAC: N-(azepan-1-yl)-3,4,5-trimethoxybenzamide.
Chemical Property Profile of Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-
Property Insights of Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-. The TPSA of 60.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-. Following Lipinski's Rule of Five, Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- has 1 hydrogen bond donor(s) and 5 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 Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-?
The CAS number of Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- is 104699-38-9.
What is the molecular formula of Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-?
The molecular formula of Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- is C16H24N2O4.
What is the molecular weight of Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-?
The molecular weight of Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- is 308.17 g/mol.
Where can I buy Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-?
You can request a quote for Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, N-(hexahydro-1H-azepin-1-yl)-3,4,5-trimethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.