![N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide structure](/static/products/5936/5936-10-7.webp)
N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide
TL;DR: N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide (CAS 5936-10-7) is a chemical compound with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-nitrobenzamide
Also Known As: N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide, N-butyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-nitrobenzamide
| Molecular Formula | C24H27N3O4 |
|---|---|
| Molecular Weight | 421.20 g/mol |
| LogP | 4.8957 |
| Topological Polar Surface Area | 77.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 421.20016 |
| Heavy Atoms | 31 |
| Complexity | 1044.5635 |
Chemical Identifiers
| CAS Number | 5936-10-7 |
|---|---|
| SMILES | CCCCN(CC1=CC=CN1CC2=CC(=CC=C2)OC)C(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide (CAS 5936-10-7), with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol. IUPAC: N-butyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-nitrobenzamide.
Chemical Property Profile of N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide
Property Insights of N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide
The XLogP value of 4.8957 indicates that N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.61 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide. Following Lipinski's Rule of Five, N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide has 0 hydrogen bond donor(s) and 4 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-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide?
The CAS number of N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide is 5936-10-7.
What is the molecular formula of N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide?
The molecular formula of N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide is C24H27N3O4.
What is the molecular weight of N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide?
The molecular weight of N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide is 421.20 g/mol.
Where can I buy N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide?
You can request a quote for N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-Butyl-N-({1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl}methyl)-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.