p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate
TL;DR: p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate (CAS 101035-05-6) is a chemical compound with molecular formula C23H28N2O6 and molecular weight 428.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-benzoyl-4-ethoxyanilino)ethyl-dimethylazanium;(E)-4-hydroxy-4-oxobut-2-enoate
Also Known As: N-(2-(Dimethylamino)ethyl)-p-benzophenetidide fumarate, p-BENZOPHENETIDIDE, N-(2-(DIMETHYLAMINO)ETHYL)-, FUMARATE, p-BENZOPHENETIDIDE,N-(2-(DIMETHYLAMINO)ETHYL)-,FUMARATE, 2-(N-benzoyl-4-ethoxyanilino)ethyl-dimethylazanium;(E)-4-hydroxy-4-oxobut-2-enoate, 2-(N-benzoyl-4-ethoxyanilino)ethyl-dimethylazanium,(E)-4-hydroxy-4-oxobut-2-enoate
| Molecular Formula | C23H28N2O6 |
|---|---|
| Molecular Weight | 428.19 g/mol |
| LogP | 0.2537 |
| Topological Polar Surface Area | 111.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 428.19473 |
| Heavy Atoms | 31 |
| Complexity | 847.39526 |
Chemical Identifiers
| CAS Number | 101035-05-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N(CC[NH+](C)C)C(=O)C2=CC=CC=C2.C(=C/C(=O)[O-])\C(=O)O |
Product Overview
p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate (CAS 101035-05-6), with molecular formula C23H28N2O6 and molecular weight 428.19 g/mol. IUPAC: 2-(N-benzoyl-4-ethoxyanilino)ethyl-dimethylazanium;(E)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate
Property Insights of p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate
The XLogP value of 0.2537 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate. The TPSA of 111.41 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate. Following Lipinski's Rule of Five, p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate has 2 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 p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate?
The CAS number of p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate is 101035-05-6.
What is the molecular formula of p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate?
The molecular formula of p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate is C23H28N2O6.
What is the molecular weight of p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate?
The molecular weight of p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate is 428.19 g/mol.
Where can I buy p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate?
You can request a quote for p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate?
Yes, KEHONG BIO provides custom synthesis services for p-Benzophenetidide, N-(2-(dimethylamino)ethyl)-, fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.