![4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide structure](/static/products/889/889955-58-2.png)
4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide
TL;DR: 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide (CAS 889955-58-2) is a chemical compound with molecular formula C19H17N3O3 and molecular weight 335.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-nitro-N-[(4-pyrrol-1-ylphenyl)methyl]benzamide
Also Known As: 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide, 4-Methyl-3-nitro-N-[[4-(1H-pyrrol-1-yl)phenyl]methyl]benzamide, 4-methyl-3-nitro-N-[(4-pyrrol-1-ylphenyl)methyl]benzamide, A3924/0166969, 4-METHYL-3-NITRO-N-{[4-(1H-PYRROL-1-YL)PHENYL]METHYL}BENZAMIDE
| Molecular Formula | C19H17N3O3 |
|---|---|
| Molecular Weight | 335.13 g/mol |
| LogP | 3.62392 |
| Topological Polar Surface Area | 77.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.12698 |
| Heavy Atoms | 25 |
| Complexity | 900.1736 |
Chemical Identifiers
| CAS Number | 889955-58-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)N3C=CC=C3)[N+](=O)[O-] |
Product Overview
4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide (CAS 889955-58-2), with molecular formula C19H17N3O3 and molecular weight 335.13 g/mol. IUPAC: 4-methyl-3-nitro-N-[(4-pyrrol-1-ylphenyl)methyl]benzamide.
Chemical Property Profile of 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide
Property Insights of 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide
The XLogP value of 3.62392 indicates that 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide. Following Lipinski's Rule of Five, 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide has 1 hydrogen bond donor(s) and 3 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-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide?
The CAS number of 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide is 889955-58-2.
What is the molecular formula of 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide?
The molecular formula of 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide is C19H17N3O3.
What is the molecular weight of 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide?
The molecular weight of 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide is 335.13 g/mol.
Where can I buy 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide?
You can request a quote for 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-nitro-N-[4-(1H-pyrrol-1-yl)benzyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.