2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole
TL;DR: 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole (CAS 691849-74-8) is a chemical compound with molecular formula C12H15NS and molecular weight 205.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethyl-1-[(3-methylthiophen-2-yl)methyl]pyrrole
Also Known As: Maybridge3_002253, IDI1_013640, 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole, 2,5-dimethyl-1-[(3-methylthiophen-2-yl)methyl]pyrrole
| Molecular Formula | C12H15NS |
|---|---|
| Molecular Weight | 205.09 g/mol |
| LogP | 3.52316 |
| Topological Polar Surface Area | 4.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.09251 |
| Heavy Atoms | 14 |
| Complexity | 417.36636 |
Chemical Identifiers
| CAS Number | 691849-74-8 |
|---|---|
| SMILES | CC1=C(SC=C1)CN2C(=CC=C2C)C |
Product Overview
2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole (CAS 691849-74-8), with molecular formula C12H15NS and molecular weight 205.09 g/mol. IUPAC: 2,5-dimethyl-1-[(3-methylthiophen-2-yl)methyl]pyrrole.
Chemical Property Profile of 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole
Property Insights of 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole
The XLogP value of 3.52316 indicates that 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.93 Ų, 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole has 0 hydrogen bond donor(s) and 1 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 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole?
The CAS number of 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole is 691849-74-8.
What is the molecular formula of 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole?
The molecular formula of 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole is C12H15NS.
What is the molecular weight of 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole?
The molecular weight of 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole is 205.09 g/mol.
Where can I buy 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole?
You can request a quote for 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-1-((3-methylthiophen-2-yl)methyl)-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.