![Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate structure](/static/products/5553/55536-71-5.webp)
Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate
TL;DR: Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate (CAS 55536-71-5) is a chemical compound with molecular formula C17H27NO4 and molecular weight 309.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-[4-[bis(2-hydroxyethyl)amino]phenyl]butanoate
Also Known As: Isopropyl 4-(4-(bis(2-hydroxyethyl)amino)phenyl)butanoate, EINECS 301-868-6, ISOPROPYL 4-[4-[N,N-BIS(2-HYDROXYETHYL)AMINO]PHENYL]BUTYRATE, 1-Methylethyl 4-[bis(2-hydroxyethyl)amino]benzenebutanoate, Isopropyl 4-(4-(N,N-bis(2-hydroxyethyl)amino)phenyl)butyrate
| Molecular Formula | C17H27NO4 |
|---|---|
| Molecular Weight | 309.19 g/mol |
| LogP | 1.7519 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 309.194 |
| Heavy Atoms | 22 |
| Complexity | 424.79 |
Chemical Identifiers
| CAS Number | 55536-71-5 |
|---|---|
| SMILES | CC(C)OC(=O)CCCC1=CC=C(C=C1)N(CCO)CCO |
Product Overview
Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate (CAS 55536-71-5), with molecular formula C17H27NO4 and molecular weight 309.19 g/mol. IUPAC: propan-2-yl 4-[4-[bis(2-hydroxyethyl)amino]phenyl]butanoate.
Chemical Property Profile of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate
Property Insights of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate
The XLogP value of 1.7519 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate. Following Lipinski's Rule of Five, Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate 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 Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate?
The CAS number of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate is 55536-71-5.
What is the molecular formula of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate?
The molecular formula of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate is C17H27NO4.
What is the molecular weight of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate?
The molecular weight of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate is 309.19 g/mol.
Where can I buy Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate?
You can request a quote for Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.