methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide
TL;DR: methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide (CAS 338977-19-8) is a chemical compound with molecular formula C13H11NS2 and molecular weight 245.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-methylsulfanylphenyl)thieno[2,3-c]pyrrole
Also Known As: Bionet2_001436, 5-(3-methylsulfanylphenyl)thieno[2,3-c]pyrrole, methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide, 5-[3-(methylsulfanyl)phenyl]-5H-thieno[2,3-c]pyrrole, 9E-044
| Molecular Formula | C13H11NS2 |
|---|---|
| Molecular Weight | 245.03 g/mol |
| LogP | 4.4139 |
| Topological Polar Surface Area | 4.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.0333 |
| Heavy Atoms | 16 |
| Complexity | 592.9439 |
Chemical Identifiers
| CAS Number | 338977-19-8 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)N2C=C3C=CSC3=C2 |
Product Overview
methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide (CAS 338977-19-8), with molecular formula C13H11NS2 and molecular weight 245.03 g/mol. IUPAC: 5-(3-methylsulfanylphenyl)thieno[2,3-c]pyrrole.
Chemical Property Profile of methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide
Property Insights of methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide
The XLogP value of 4.4139 indicates that methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.93 Ų, methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide has 0 hydrogen bond donor(s) and 2 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 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide?
The CAS number of methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide is 338977-19-8.
What is the molecular formula of methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide?
The molecular formula of methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide is C13H11NS2.
What is the molecular weight of methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide?
The molecular weight of methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide is 245.03 g/mol.
Where can I buy methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide?
You can request a quote for methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(5H-thieno[2,3-c]pyrrol-5-yl)phenyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.