![4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol structure](/static/products/524/524746-06-3.png)
4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol
TL;DR: 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol (CAS 524746-06-3) is a chemical compound with molecular formula C15H17NO and molecular weight 227.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol
Also Known As: Phenol, 4-[(4-ethyl-3,5-dimethyl-2H-pyrrol-2-ylidene)methyl]- (9CI)
| Molecular Formula | C15H17NO |
|---|---|
| Molecular Weight | 227.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.13101 |
| Heavy Atoms | 17 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 524746-06-3 |
|---|---|
| SMILES | CCC1=C(C(=CC2=CC=C(C=C2)O)N=C1C)C |
| InChIKey | HCGSNSFXQIWHPR-UHFFFAOYSA-N |
Product Overview
4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol (CAS 524746-06-3), with molecular formula C15H17NO and molecular weight 227.13 g/mol. IUPAC: 4-[(4-ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol.
Chemical Property Profile of 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol
Property Insights of 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol. With a topological polar surface area (TPSA) of 32.6 Ų, 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol 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 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol?
The CAS number of 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol is 524746-06-3.
What is the molecular formula of 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol?
The molecular formula of 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol is C15H17NO.
What is the molecular weight of 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol?
The molecular weight of 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol is 227.13 g/mol.
Where can I buy 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol?
You can request a quote for 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Ethyl-3,5-dimethylpyrrol-2-ylidene)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.