VU0488781-1
TL;DR: VU0488781-1 (CAS 478653-58-6) is a chemical compound with molecular formula C16H26ClNO4 and molecular weight 331.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(2-hydroxyethyl)amino]-3-(2-prop-2-enylphenoxy)propan-2-ol;hydrochloride
Also Known As: VU0488781-1, 1-[BIS(2-HYDROXYETHYL)AMINO]-3-[2-(PROP-2-EN-1-YL)PHENOXY]PROPAN-2-OL HYDROCHLORIDE, F0840-0179, 2,2'-((3-(2-allylphenoxy)-2-hydroxypropyl)azanediyl)diethanol hydrochloride, 1-(bis(2-hydroxyethyl)amino)-3-(2-prop-2-enylphenoxy)propan-2-ol Hydrochloride
| Molecular Formula | C16H26ClNO4 |
|---|---|
| Molecular Weight | 331.16 g/mol |
| LogP | 0.8632 |
| Topological Polar Surface Area | 73.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 331.15503 |
| Heavy Atoms | 22 |
| Complexity | 410.8872 |
Chemical Identifiers
| CAS Number | 478653-58-6 |
|---|---|
| SMILES | C=CCC1=CC=CC=C1OCC(CN(CCO)CCO)O.Cl |
Product Overview
VU0488781-1 (CAS 478653-58-6), with molecular formula C16H26ClNO4 and molecular weight 331.16 g/mol. IUPAC: 1-[bis(2-hydroxyethyl)amino]-3-(2-prop-2-enylphenoxy)propan-2-ol;hydrochloride.
Chemical Property Profile of VU0488781-1
Property Insights of VU0488781-1
The XLogP value of 0.8632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0488781-1. The TPSA of 73.16 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0488781-1. Following Lipinski's Rule of Five, VU0488781-1 has 3 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 VU0488781-1?
The CAS number of VU0488781-1 is 478653-58-6.
What is the molecular formula of VU0488781-1?
The molecular formula of VU0488781-1 is C16H26ClNO4.
What is the molecular weight of VU0488781-1?
The molecular weight of VU0488781-1 is 331.16 g/mol.
Where can I buy VU0488781-1?
You can request a quote for VU0488781-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0488781-1?
Yes, KEHONG BIO provides custom synthesis services for VU0488781-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.