1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile
TL;DR: 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile (CAS 355819-97-5) is a chemical compound with molecular formula C19H17N3O4 and molecular weight 351.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile
Also Known As: 1-(4-methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile, 1-[(4-methoxy-3-nitrophenyl)carbonyl]-2-phenylpyrrolidine-2-carbonitrile, 1-(4-methoxy-3-nitro-benzoyl)-2-phenyl-pyrrolidine-2-carbonitrile
| Molecular Formula | C19H17N3O4 |
|---|---|
| Molecular Weight | 351.12 g/mol |
| LogP | 3.25848 |
| Topological Polar Surface Area | 96.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.12192 |
| Heavy Atoms | 26 |
| Complexity | 891.4024 |
Chemical Identifiers
| CAS Number | 355819-97-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)N2CCCC2(C#N)C3=CC=CC=C3)[N+](=O)[O-] |
Product Overview
1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile (CAS 355819-97-5), with molecular formula C19H17N3O4 and molecular weight 351.12 g/mol. IUPAC: 1-(4-methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile.
Chemical Property Profile of 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile
Property Insights of 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile
The XLogP value of 3.25848 indicates that 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile. Following Lipinski's Rule of Five, 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile has 0 hydrogen bond donor(s) and 5 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 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile?
The CAS number of 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile is 355819-97-5.
What is the molecular formula of 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile?
The molecular formula of 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile is C19H17N3O4.
What is the molecular weight of 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile?
The molecular weight of 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile is 351.12 g/mol.
Where can I buy 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile?
You can request a quote for 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxy-3-nitrobenzoyl)-2-phenylpyrrolidine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.