5-(Methylthio)-1H-pyrrole-2-carboxaldehyde
TL;DR: 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde (CAS 90724-50-8) is a chemical compound with molecular formula C6H7NOS and molecular weight 141.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylsulfanyl-1H-pyrrole-2-carbaldehyde
Also Known As: 1H-Pyrrole-2-carboxaldehyde,5-(methylthio)-, 5-(METHYLSULFANYL)-1H-PYRROLE-2-CARBALDEHYDE, 5-(Methylthio)-1H-pyrrole-2-carbaldehyde, 1H-Pyrrole-2-carboxaldehyde,5- -, 5-methylsulfanyl-1H-pyrrole-2-carbaldehyde
| Molecular Formula | C6H7NOS |
|---|---|
| Molecular Weight | 141.02 g/mol |
| LogP | 1.5491 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.02484 |
| Heavy Atoms | 9 |
| Complexity | 206.57771 |
Chemical Identifiers
| CAS Number | 90724-50-8 |
|---|---|
| SMILES | CSC1=CC=C(N1)C=O |
Product Overview
5-(Methylthio)-1H-pyrrole-2-carboxaldehyde (CAS 90724-50-8), with molecular formula C6H7NOS and molecular weight 141.02 g/mol. IUPAC: 5-methylsulfanyl-1H-pyrrole-2-carbaldehyde.
Chemical Property Profile of 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde
Property Insights of 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde
The XLogP value of 1.5491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde. With a topological polar surface area (TPSA) of 32.86 Ų, 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde has 1 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 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde?
The CAS number of 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde is 90724-50-8.
What is the molecular formula of 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde?
The molecular formula of 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde is C6H7NOS.
What is the molecular weight of 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde?
The molecular weight of 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde is 141.02 g/mol.
Where can I buy 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde?
You can request a quote for 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-(Methylthio)-1H-pyrrole-2-carboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.