17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)
TL;DR: 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) (CAS 63868-12-2) is a chemical compound with molecular formula C26H32ClNO2 and molecular weight 425.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,9R,10R)-17-(2-phenylethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-yl] acetate;hydrochloride
Also Known As: (-)-17-Phenethylmorphinan-3-ol acetate (ester) hydrochloride, Morphinan-3-ol, 17-phenethyl-, acetate (ester), hydrochloride, (-)-, 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1), Morphinan-3-ol, 17-(2-phenylethyl)-, acetate (ester), hydrochloride, RefChem:1057591
| Molecular Formula | C26H32ClNO2 |
|---|---|
| Molecular Weight | 425.21 g/mol |
| LogP | 5.3348 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 425.21216 |
| Heavy Atoms | 30 |
| Complexity | 899.16156 |
Chemical Identifiers
| CAS Number | 63868-12-2 |
|---|---|
| SMILES | CC(=O)OC1=CC2=C(C[C@@H]3[C@H]4[C@@]2(CCCC4)CCN3CCC5=CC=CC=C5)C=C1.Cl |
Product Overview
17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) (CAS 63868-12-2), with molecular formula C26H32ClNO2 and molecular weight 425.21 g/mol. IUPAC: [(1R,9R,10R)-17-(2-phenylethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-yl] acetate;hydrochloride.
Chemical Property Profile of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)
Property Insights of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)
The XLogP value of 5.3348 indicates that 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)?
The CAS number of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) is 63868-12-2.
What is the molecular formula of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)?
The molecular formula of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) is C26H32ClNO2.
What is the molecular weight of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)?
The molecular weight of 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) is 425.21 g/mol.
Where can I buy 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)?
You can request a quote for 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 17-(2-Phenylethyl)morphinan-3-yl acetate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.