(S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate
TL;DR: (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate (CAS 10418-01-6) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-benzamido-3-(4-hydroxyphenyl)propanoate
Also Known As: methyl N-benzoyltyrosinate, N-benzoyl-l-tyrosine methyl ester, (S)-METHYL 2-BENZAMIDO-3-(4-HYDROXYPHENYL)PROPANOATE, methyl (2S)-2-benzamido-3-(4-hydroxyphenyl)propanoate, methyl (2S)-3-(4-hydroxyphenyl)-2-(phenylformamido)propanoate
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 10418-01-6 |
|---|---|
| SMILES | COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2=CC=CC=C2 |
| InChIKey | GFVUIPNILAJZEC-HNNXBMFYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate (CAS 10418-01-6), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: methyl (2S)-2-benzamido-3-(4-hydroxyphenyl)propanoate.
Chemical Property Profile of (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate
Property Insights of (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate. Following Lipinski's Rule of Five, (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate has 2 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 (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate?
The CAS number of (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate is 10418-01-6.
What is the molecular formula of (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate?
The molecular formula of (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate is C17H17NO4.
What is the molecular weight of (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate?
The molecular weight of (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate is 299.12 g/mol.
Where can I buy (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate?
You can request a quote for (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-Methyl 2-benzamido-3-(4-hydroxyphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.