17-(环丁基甲基)吗啡烷-3,14-二醇
TL;DR: 17-(环丁基甲基)吗啡烷-3,14-二醇 (CAS 1287084-97-2) is a chemical compound with molecular formula C21H29NO2 and molecular weight 327.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(环丁基甲基)吗啡烷-3,14-二醇
17-(cyclobutylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol
Also Known As: butorphanol, Torbugesic, Torbutrol, Stadol, Stadol NS
| Molecular Formula | C21H29NO2 |
|---|---|
| Molecular Weight | 327.22 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.21982 |
| Heavy Atoms | 24 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 1287084-97-2 |
|---|---|
| SMILES | C1CCC2(C3CC4=C(C2(C1)CCN3CC5CCC5)C=C(C=C4)O)O |
| InChIKey | IFKLAQQSCNILHL-UHFFFAOYSA-N |
Product Overview
17-(环丁基甲基)吗啡烷-3,14-二醇 (CAS 1287084-97-2), with molecular formula C21H29NO2 and molecular weight 327.22 g/mol. IUPAC: 17-(cyclobutylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol.
Chemical Property Profile of 17-(环丁基甲基)吗啡烷-3,14-二醇
Property Insights of 17-(环丁基甲基)吗啡烷-3,14-二醇
The XLogP value of 3.8 indicates that 17-(环丁基甲基)吗啡烷-3,14-二醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, 17-(环丁基甲基)吗啡烷-3,14-二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-(环丁基甲基)吗啡烷-3,14-二醇 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 17-(环丁基甲基)吗啡烷-3,14-二醇?
The CAS number of 17-(环丁基甲基)吗啡烷-3,14-二醇 is 1287084-97-2.
What is the molecular formula of 17-(环丁基甲基)吗啡烷-3,14-二醇?
The molecular formula of 17-(环丁基甲基)吗啡烷-3,14-二醇 is C21H29NO2.
What is the molecular weight of 17-(环丁基甲基)吗啡烷-3,14-二醇?
The molecular weight of 17-(环丁基甲基)吗啡烷-3,14-二醇 is 327.22 g/mol.
Where can I buy 17-(环丁基甲基)吗啡烷-3,14-二醇?
You can request a quote for 17-(环丁基甲基)吗啡烷-3,14-二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-(环丁基甲基)吗啡烷-3,14-二醇?
Yes, KEHONG BIO provides custom synthesis services for 17-(环丁基甲基)吗啡烷-3,14-二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.