Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate
TL;DR: Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate (CAS 300702-46-9) is a chemical compound with molecular formula C20H26N2O2 and molecular weight 326.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-[[4-(dimethylamino)phenyl]methylamino]benzoate
Also Known As: butyl 4-((4-(dimethylamino)benzyl)amino)benzoate, butyl 4-{[4-(dimethylamino)benzyl]amino}benzoate, butyl 4-[(4-dimethylaminophenyl)methylamino]benzoate
| Molecular Formula | C20H26N2O2 |
|---|---|
| Molecular Weight | 326.20 g/mol |
| LogP | 4.3216 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 326.19943 |
| Heavy Atoms | 24 |
| Complexity | 633.69336 |
Chemical Identifiers
| CAS Number | 300702-46-9 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=C(C=C1)NCC2=CC=C(C=C2)N(C)C |
Product Overview
Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate (CAS 300702-46-9), with molecular formula C20H26N2O2 and molecular weight 326.20 g/mol. IUPAC: butyl 4-[[4-(dimethylamino)phenyl]methylamino]benzoate.
Chemical Property Profile of Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate
Property Insights of Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate
The XLogP value of 4.3216 indicates that Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate has 1 hydrogen bond donor(s) and 4 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 Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate?
The CAS number of Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate is 300702-46-9.
What is the molecular formula of Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate?
The molecular formula of Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate is C20H26N2O2.
What is the molecular weight of Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate?
The molecular weight of Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate is 326.20 g/mol.
Where can I buy Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate?
You can request a quote for Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 4-((4-(dimethylamino)benzyl)amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.