N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine
TL;DR: N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine (CAS 7149-99-7) is a chemical compound with molecular formula C18H19NO5 and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzamido-3-(2,6-dimethoxyphenyl)propanoic acid
Also Known As: n-benzoyl-2,6-dimethoxyphenylalanine, 2-benzamido-3-(2,6-dimethoxyphenyl)propanoic acid, N-BENZOYL-3-(2,6-DIMETHOXYPHENYL)ALANINE, 3-(2,6-dimethoxyphenyl)-2-(phenylformamido)propanoic acid, 668-287-0
| Molecular Formula | C18H19NO5 |
|---|---|
| Molecular Weight | 329.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 329.1263 |
| Heavy Atoms | 24 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 7149-99-7 |
|---|---|
| SMILES | COC1=C(C(=CC=C1)OC)CC(C(=O)O)NC(=O)C2=CC=CC=C2 |
| InChIKey | OWCQIUGJSIZQLX-UHFFFAOYSA-N |
Product Overview
N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine (CAS 7149-99-7), with molecular formula C18H19NO5 and molecular weight 329.13 g/mol. IUPAC: 2-benzamido-3-(2,6-dimethoxyphenyl)propanoic acid.
Chemical Property Profile of N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine
Property Insights of N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine. Following Lipinski's Rule of Five, N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine has 2 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 N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine?
The CAS number of N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine is 7149-99-7.
What is the molecular formula of N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine?
The molecular formula of N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine is C18H19NO5.
What is the molecular weight of N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine?
The molecular weight of N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine is 329.13 g/mol.
Where can I buy N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine?
You can request a quote for N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzoyl-3-(2,6-dimethoxyphenyl)alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.