methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate
TL;DR: methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate (CAS 956807-64-0) is a chemical compound with molecular formula C17H26N2O5S and molecular weight 370.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-4-methylsulfanylbutanoate
Also Known As: methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate, (S)-methyl 2-(3-(3,4-dimethoxyphenethyl)ureido)-4-(methylthio)butanoate, methyl (2S)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-4-methylsulfanylbutanoate
| Molecular Formula | C17H26N2O5S |
|---|---|
| Molecular Weight | 370.16 g/mol |
| LogP | 1.8402 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 370.15625 |
| Heavy Atoms | 25 |
| Complexity | 567.96924 |
Chemical Identifiers
| CAS Number | 956807-64-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)N[C@@H](CCSC)C(=O)OC)OC |
Product Overview
methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate (CAS 956807-64-0), with molecular formula C17H26N2O5S and molecular weight 370.16 g/mol. IUPAC: methyl (2S)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-4-methylsulfanylbutanoate.
Chemical Property Profile of methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate
Property Insights of methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate
The XLogP value of 1.8402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate. Following Lipinski's Rule of Five, methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate has 2 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 methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate?
The CAS number of methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate is 956807-64-0.
What is the molecular formula of methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate?
The molecular formula of methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate is C17H26N2O5S.
What is the molecular weight of methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate?
The molecular weight of methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate is 370.16 g/mol.
Where can I buy methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate?
You can request a quote for methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-L-methioninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.