17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol
TL;DR: 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol (CAS 77287-89-9) is a chemical compound with molecular formula C23H31NO and molecular weight 337.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9S,10R,11S)-17-(cyclobutylmethyl)-11-methyl-13-methylidene-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol
Also Known As: Xorphanol, 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol
| Molecular Formula | C23H31NO |
|---|---|
| Molecular Weight | 337.24 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.24057 |
| Heavy Atoms | 25 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 77287-89-9 |
|---|---|
| SMILES | C[C@H]1CC(=C)C[C@@]23[C@@H]1[C@H](CC4=C2C=C(C=C4)O)N(CC3)CC5CCC5 |
| InChIKey | AZJPPZHRNFQRRE-YMPRXVIZSA-N |
Product Overview
17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol (CAS 77287-89-9), with molecular formula C23H31NO and molecular weight 337.24 g/mol. IUPAC: (1R,9S,10R,11S)-17-(cyclobutylmethyl)-11-methyl-13-methylidene-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol.
Chemical Property Profile of 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol
Property Insights of 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol
The XLogP value of 5.0 indicates that 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol has 1 hydrogen bond donor(s) and 2 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 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol?
The CAS number of 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol is 77287-89-9.
What is the molecular formula of 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol?
The molecular formula of 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol is C23H31NO.
What is the molecular weight of 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol?
The molecular weight of 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol is 337.24 g/mol.
Where can I buy 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol?
You can request a quote for 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 17-(Cyclobutylmethyl)-8beta-methyl-6-methylidene-9alpha-morphinan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.