N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid
TL;DR: N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid (CAS 304481-22-9) is a chemical compound with molecular formula C21H21NO3 and molecular weight 335.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-phenylhepta-1,6-dien-4-ylcarbamoyl)benzoic acid
Also Known As: N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid, BAS 00632535, 2-((4-Phenylhepta-1,6-dien-4-yl)carbamoyl)benzoic acid, 2-(4-phenylhepta-1,6-dien-4-ylcarbamoyl)benzoic acid, 2-[(4-phenylhepta-1,6-dien-4-yl)carbamoyl]benzoic acid
| Molecular Formula | C21H21NO3 |
|---|---|
| Molecular Weight | 335.15 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 335.15213 |
| Heavy Atoms | 25 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 304481-22-9 |
|---|---|
| SMILES | C=CCC(CC=C)(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2C(=O)O |
| InChIKey | OAWYRWUNWRRPGA-UHFFFAOYSA-N |
Product Overview
N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid (CAS 304481-22-9), with molecular formula C21H21NO3 and molecular weight 335.15 g/mol. IUPAC: 2-(4-phenylhepta-1,6-dien-4-ylcarbamoyl)benzoic acid.
Chemical Property Profile of N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid
Property Insights of N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid
The XLogP value of 4.3 indicates that N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid. Following Lipinski's Rule of Five, N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid has 2 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 N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid?
The CAS number of N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid is 304481-22-9.
What is the molecular formula of N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid?
The molecular formula of N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid is C21H21NO3.
What is the molecular weight of N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid?
The molecular weight of N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid is 335.15 g/mol.
Where can I buy N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid?
You can request a quote for N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Allyl-1-phenyl-but-3-enyl)-phthalamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.