RefChem:315510
TL;DR: RefChem:315510 (CAS 27471-61-0) is a chemical compound with molecular formula C26H39ClN2O4 and molecular weight 478.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(N-[2-(4-butoxyphenoxy)acetyl]-3-methoxyanilino)propyl-diethylazanium chloride
Also Known As: Acetamide, N-(m-anisyl)-2-(p-butoxyphenoxy)-N-(3-(diethylamino)propyl)-, hydrochloride, m-Acetanisidide, 2-(p-butoxyphenoxy)-N-(3-(diethylamino)propyl)-, monohydrochloride, 2-(4-Butoxyphenoxy)-N-[3-(diethylamino)propyl]-N-(3-methoxyphenyl)acetamide;hydrochloride, 3-(N-[2-(4-butoxyphenoxy)acetyl]-3-methoxyanilino)propyl-diethylazanium chloride, ACETAMIDE, N-(m-ANISYL)-2-(p-BUTOXYPHENOXY)-N-(3-(DIETHYLAMINO)PROPYL)-, HYDROCH
| Molecular Formula | C26H39ClN2O4 |
|---|---|
| Molecular Weight | 478.26 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 52.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 478.25983 |
| Heavy Atoms | 33 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 27471-61-0 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)OCC(=O)N(CCC[NH+](CC)CC)C2=CC(=CC=C2)OC.[Cl-] |
| InChIKey | DDZPFBBCIRKVTQ-UHFFFAOYSA-N |
Product Overview
RefChem:315510 (CAS 27471-61-0), with molecular formula C26H39ClN2O4 and molecular weight 478.26 g/mol. IUPAC: 3-(N-[2-(4-butoxyphenoxy)acetyl]-3-methoxyanilino)propyl-diethylazanium chloride.
Chemical Property Profile of RefChem:315510
Property Insights of RefChem:315510
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:315510. With a topological polar surface area (TPSA) of 52.4 Ų, RefChem:315510 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:315510 has 1 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 RefChem:315510?
The CAS number of RefChem:315510 is 27471-61-0.
What is the molecular formula of RefChem:315510?
The molecular formula of RefChem:315510 is C26H39ClN2O4.
What is the molecular weight of RefChem:315510?
The molecular weight of RefChem:315510 is 478.26 g/mol.
Where can I buy RefChem:315510?
You can request a quote for RefChem:315510 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:315510?
Yes, KEHONG BIO provides custom synthesis services for RefChem:315510 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.