![methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate structure](/static/products/560/56010-98-1.png)
methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate
TL;DR: methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate (CAS 56010-98-1) is a chemical compound with molecular formula C16H21NO3S2 and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate
Also Known As: methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate
| Molecular Formula | C16H21NO3S2 |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 2.71972 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 339.09628 |
| Heavy Atoms | 22 |
| Complexity | 514.62714 |
Chemical Identifiers
| CAS Number | 56010-98-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C/C(=O)NC(CSCSC)C(=O)OC |
Product Overview
methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate (CAS 56010-98-1), with molecular formula C16H21NO3S2 and molecular weight 339.10 g/mol. IUPAC: methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate.
Chemical Property Profile of methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate
Property Insights of methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate
The XLogP value of 2.71972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate. With a topological polar surface area (TPSA) of 55.4 Ų, methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate 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 methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate?
The CAS number of methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate is 56010-98-1.
What is the molecular formula of methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate?
The molecular formula of methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate is C16H21NO3S2.
What is the molecular weight of methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate?
The molecular weight of methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate is 339.10 g/mol.
Where can I buy methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate?
You can request a quote for methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-3-(methylsulfanylmethylsulfanyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.