N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide
TL;DR: N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide (CAS 477887-14-2) is a chemical compound with molecular formula C31H23N3O and molecular weight 453.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide
Also Known As: 2P-322S, N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide, N-(1-benzyl-3-cyano-4,5-diphenyl-1H-pyrrol-2-yl)benzenecarboxamide, N-(1-benzyl-3-cyano-4,5-diphenyl-pyrrol-2-yl)benzamide, N-(1-benzyl-3-cyano-4,5-diphenyl-1H-pyrrol-2-yl)benzamide
| Molecular Formula | C31H23N3O |
|---|---|
| Molecular Weight | 453.18 g/mol |
| LogP | 6.99438 |
| Topological Polar Surface Area | 57.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.1841 |
| Heavy Atoms | 35 |
| Complexity | 1483.6809 |
Chemical Identifiers
| CAS Number | 477887-14-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=C(C(=C2NC(=O)C3=CC=CC=C3)C#N)C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide (CAS 477887-14-2), with molecular formula C31H23N3O and molecular weight 453.18 g/mol. IUPAC: N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide.
Chemical Property Profile of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide
Property Insights of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide
The XLogP value of 6.99438 indicates that N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.82 Ų, N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide?
The CAS number of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide is 477887-14-2.
What is the molecular formula of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide?
The molecular formula of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide is C31H23N3O.
What is the molecular weight of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide?
The molecular weight of N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide is 453.18 g/mol.
Where can I buy N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide?
You can request a quote for N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-benzyl-3-cyano-4,5-diphenylpyrrol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.