methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate
TL;DR: methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate (CAS 536702-30-4) is a chemical compound with molecular formula C16H15NO3S and molecular weight 301.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(2-methyl-1H-indol-3-yl)sulfanylmethyl]furan-2-carboxylate
Also Known As: F0575-0065, methyl 5-[(2-methyl-3-indolylthio)methyl]-2-furoate, methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate, methyl 5-[(2-methyl-1H-indol-3-yl)sulfanylmethyl]furan-2-carboxylate
| Molecular Formula | C16H15NO3S |
|---|---|
| Molecular Weight | 301.08 g/mol |
| LogP | 4.14822 |
| Topological Polar Surface Area | 55.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.07727 |
| Heavy Atoms | 21 |
| Complexity | 787.7753 |
Chemical Identifiers
| CAS Number | 536702-30-4 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)SCC3=CC=C(O3)C(=O)OC |
Product Overview
methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate (CAS 536702-30-4), with molecular formula C16H15NO3S and molecular weight 301.08 g/mol. IUPAC: methyl 5-[(2-methyl-1H-indol-3-yl)sulfanylmethyl]furan-2-carboxylate.
Chemical Property Profile of methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate
Property Insights of methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate
The XLogP value of 4.14822 indicates that methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.23 Ų, methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate has 1 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 methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate?
The CAS number of methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate is 536702-30-4.
What is the molecular formula of methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate?
The molecular formula of methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate is C16H15NO3S.
What is the molecular weight of methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate?
The molecular weight of methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate is 301.08 g/mol.
Where can I buy methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate?
You can request a quote for methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-(((2-methyl-1H-indol-3-yl)thio)methyl)furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.