(S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate
TL;DR: (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate (CAS 51593-52-3) 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.
methyl (2S)-2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate
Also Known As: (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate, methyl (2S)-2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate, Methyl (S)-2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate, N-Benzoyl-3-(3-methoxy-4-hydroxyphenyl)-L-alanine methyl ester, METHYL (2S)-3-(4-HYDROXY-3-METHOXYPHENYL)-2-(PHENYLFORMAMIDO)PROPANOATE
| 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 | 422.0 |
Chemical Identifiers
| CAS Number | 51593-52-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C[C@@H](C(=O)OC)NC(=O)C2=CC=CC=C2)O |
| InChIKey | BHQKUUBRJPSPKC-AWEZNQCLSA-N |
Product Overview
(S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate (CAS 51593-52-3), with molecular formula C18H19NO5 and molecular weight 329.13 g/mol. IUPAC: methyl (2S)-2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate.
Chemical Property Profile of (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate
Property Insights of (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate. Following Lipinski's Rule of Five, (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate 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 (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate?
The CAS number of (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate is 51593-52-3.
What is the molecular formula of (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate?
The molecular formula of (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate is C18H19NO5.
What is the molecular weight of (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate?
The molecular weight of (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate is 329.13 g/mol.
Where can I buy (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate?
You can request a quote for (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)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-hydroxy-3-methoxyphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-Methyl 2-benzamido-3-(4-hydroxy-3-methoxyphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.