RefChem:1055931
TL;DR: RefChem:1055931 (CAS 63905-78-2) is a chemical compound with molecular formula C28H30ClNO2 and molecular weight 447.1965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,2-dinaphthalen-1-ylacetyl)oxyethyl-diethylazanium chloride
Also Known As: 1-Naphthaleneacetic acid, alpha-(1-naphthyl)-, 2-(diethylamino)ethyl ester, hydrochloride, 2-(2,2-dinaphthalen-1-ylacetyl)oxyethyl-diethylazanium chloride, alpha-(1-Naphthyl)-1-naphthaleneacetic acid 2-(diethylamino)ethyl ester hydrochloride, 1-Naphthaleneacetic acid, .alpha.-1-naphthalenyl-, 2-(diethylamino)ethyl ester, hydrochloride
Technical Specifications
| Molecular Formula | C28H30ClNO2 |
| Molecular Weight | 447.1965 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 447.1965 Da |
| Heavy Atoms | 32 |
| Complexity | 525.0 |
| SMILES | CC[NH+](CC)CCOC(=O)C(C1=CC=CC2=CC=CC=C21)C3=CC=CC4=CC=CC=C43.[Cl-] |
| InChIKey | SWPXLXCVTDSLNW-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1055931
Property Insights of RefChem:1055931
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1055931. With a topological polar surface area (TPSA) of 30.7 Ų, RefChem:1055931 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1055931 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1055931?
The CAS number of RefChem:1055931 is 63905-78-2.
What is the molecular formula of RefChem:1055931?
The molecular formula of RefChem:1055931 is C28H30ClNO2.
What is the molecular weight of RefChem:1055931?
The molecular weight of RefChem:1055931 is 447.1965 g/mol.
Where can I buy RefChem:1055931?
You can request a quote for RefChem:1055931 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1055931?
Yes, CoreyChem provides custom synthesis services for RefChem:1055931 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.