2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one
TL;DR: 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one (CAS 379244-16-3) is a chemical compound with molecular formula C13H14ClNO2 and molecular weight 251.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]ethanone
Also Known As: BAS 04282578, 2-chloro-1-[1-(furan-2-ylmethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one, 2-Chloro-1-(1-furan-2-ylmethyl-2,5-dimethyl-1H-pyrrol-3-yl)-ethanone, 2-chloro-1-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]ethanone, 2-chloro-1-{1-[(furan-2-yl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}ethan-1-one
| Molecular Formula | C13H14ClNO2 |
|---|---|
| Molecular Weight | 251.07 g/mol |
| LogP | 3.16774 |
| Topological Polar Surface Area | 35.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.0713 |
| Heavy Atoms | 17 |
| Complexity | 525.8619 |
Chemical Identifiers
| CAS Number | 379244-16-3 |
|---|---|
| SMILES | CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)CCl |
Product Overview
2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one (CAS 379244-16-3), with molecular formula C13H14ClNO2 and molecular weight 251.07 g/mol. IUPAC: 2-chloro-1-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]ethanone.
Chemical Property Profile of 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one
Property Insights of 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one
The XLogP value of 3.16774 indicates that 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.14 Ų, 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one 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 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one?
The CAS number of 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one is 379244-16-3.
What is the molecular formula of 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one?
The molecular formula of 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one is C13H14ClNO2.
What is the molecular weight of 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one?
The molecular weight of 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one is 251.07 g/mol.
Where can I buy 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one?
You can request a quote for 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-1-(1-((furan-2-yl)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.