RefChem:1054601
TL;DR: RefChem:1054601 (CAS 5404-72-8) is a chemical compound with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylmethoxy-3-(2,2,5,5-tetramethylpyrrolidin-1-yl)propan-2-ol;hydrochloride
Also Known As: 1-(benzyloxy)-3-(2,2,5,5-tetramethylpyrrolidin-1-yl)propan-2-ol hydrochloride(1:1), alpha-((Phenylmethoxy)methyl)-2,2,5,5-tetramethyl-1-pyrrolidineethanol hydrochloride, 1-Pyrrolidineethanol, alpha-((phenylmethoxy)methyl)-2,2,5,5-tetramethyl-, hydrochloride, 1-(Benzyloxy)-3-(2,2,5,5-tetramethylpyrrolidin-1-yl)propan-2-ol--hydrogen chloride (1/1), 1-phenylmethoxy-3-(2,2,5,5-tetramethylpyrrolidin-1-yl)propan-2-ol hydrochloride
| Molecular Formula | C18H30ClNO2 |
|---|---|
| Molecular Weight | 327.20 g/mol |
| LogP | 3.6389 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.1965 |
| Heavy Atoms | 22 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 5404-72-8 |
|---|---|
| SMILES | CC1(CCC(N1CC(COCC2=CC=CC=C2)O)(C)C)C.Cl |
| InChIKey | JXZWINXAWLMSGE-UHFFFAOYSA-N |
Product Overview
RefChem:1054601 (CAS 5404-72-8), with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol. IUPAC: 1-phenylmethoxy-3-(2,2,5,5-tetramethylpyrrolidin-1-yl)propan-2-ol;hydrochloride.
Chemical Property Profile of RefChem:1054601
Property Insights of RefChem:1054601
The XLogP value of 3.6389 indicates that RefChem:1054601 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, RefChem:1054601 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1054601 has 2 hydrogen bond donor(s) and 3 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:1054601?
The CAS number of RefChem:1054601 is 5404-72-8.
What is the molecular formula of RefChem:1054601?
The molecular formula of RefChem:1054601 is C18H30ClNO2.
What is the molecular weight of RefChem:1054601?
The molecular weight of RefChem:1054601 is 327.20 g/mol.
Where can I buy RefChem:1054601?
You can request a quote for RefChem:1054601 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1054601?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1054601 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.