![N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide structure](/static/products/866/866010-77-7.png)
N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide
TL;DR: N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide (CAS 866010-77-7) is a chemical compound with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-pyrrol-1-ylphenyl)methyl]benzenesulfonamide
Also Known As: N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide, N-[(4-pyrrol-1-ylphenyl)methyl]benzenesulfonamide, N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}benzenesulfonamide
| Molecular Formula | C17H16N2O2S |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 2.9558 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.09326 |
| Heavy Atoms | 22 |
| Complexity | 824.1351 |
Chemical Identifiers
| CAS Number | 866010-77-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)N3C=CC=C3 |
Product Overview
N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide (CAS 866010-77-7), with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol. IUPAC: N-[(4-pyrrol-1-ylphenyl)methyl]benzenesulfonamide.
Chemical Property Profile of N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide
Property Insights of N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide
The XLogP value of 2.9558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide. With a topological polar surface area (TPSA) of 51.1 Ų, N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide 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 N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide?
The CAS number of N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide is 866010-77-7.
What is the molecular formula of N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide?
The molecular formula of N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide is C17H16N2O2S.
What is the molecular weight of N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide?
The molecular weight of N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide is 312.09 g/mol.
Where can I buy N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide?
You can request a quote for N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(1H-pyrrol-1-yl)benzyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.