![[4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate structure](/static/products/7475/7475-90-3.webp)
[4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate
TL;DR: [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate (CAS 7475-90-3) is a chemical compound with molecular formula C27H39N3O4 and molecular weight 469.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate
Also Known As: [4-(diethylamino)-2-(2-diethylaminoethyl)-2-phenylbutyl] 4-nitrobenzoate|[4-(diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate|4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl 4-nitrobenzoate
| Molecular Formula | C27H39N3O4 |
|---|---|
| Molecular Weight | 469.29 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 469.29407 |
| Heavy Atoms | 34 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 7475-90-3 |
|---|---|
| SMILES | CCN(CC)CCC(CCN(CC)CC)(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2 |
| InChIKey | HHCZCSDVRJAIGA-UHFFFAOYSA-N |
Product Overview
[4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate (CAS 7475-90-3), with molecular formula C27H39N3O4 and molecular weight 469.29 g/mol. IUPAC: [4-(diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate.
Chemical Property Profile of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate
Property Insights of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate
The XLogP value of 5.6 indicates that [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate. Following Lipinski's Rule of Five, [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate?
The CAS number of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate is 7475-90-3.
What is the molecular formula of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate?
The molecular formula of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate is C27H39N3O4.
What is the molecular weight of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate?
The molecular weight of [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate is 469.29 g/mol.
Where can I buy [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate?
You can request a quote for [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [4-(Diethylamino)-2-[2-(diethylamino)ethyl]-2-phenylbutyl] 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.