Hydroxybutorphanol
TL;DR: Hydroxybutorphanol (CAS 75195-49-2) is a chemical compound with molecular formula C21H29NO3 and molecular weight 343.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-[(3-hydroxycyclobutyl)methyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol
Also Known As: Hydroxybutorphanol, 3-Hydroxybutorphanol, 17-[(3-Hydroxycyclobutyl)methyl]morphinan-3,14-diol, (1R,9S,10S)-17-[(3-Hydroxycyclobutyl)methyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol, 17-[(3-hydroxycyclobutyl)methyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol
| Molecular Formula | C21H29NO3 |
|---|---|
| Molecular Weight | 343.21 g/mol |
| LogP | 2.3364 |
| Topological Polar Surface Area | 63.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.21475 |
| Heavy Atoms | 25 |
| Complexity | 685.71875 |
Chemical Identifiers
| CAS Number | 75195-49-2 |
|---|---|
| SMILES | C1CCC2(C3CC4=C(C2(C1)CCN3CC5CC(C5)O)C=C(C=C4)O)O |
Product Overview
Hydroxybutorphanol (CAS 75195-49-2), with molecular formula C21H29NO3 and molecular weight 343.21 g/mol. IUPAC: 17-[(3-hydroxycyclobutyl)methyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol.
Chemical Property Profile of Hydroxybutorphanol
Property Insights of Hydroxybutorphanol
The XLogP value of 2.3364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxybutorphanol. The TPSA of 63.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxybutorphanol. Following Lipinski's Rule of Five, Hydroxybutorphanol has 3 hydrogen bond donor(s) and 4 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 Hydroxybutorphanol?
The CAS number of Hydroxybutorphanol is 75195-49-2.
What is the molecular formula of Hydroxybutorphanol?
The molecular formula of Hydroxybutorphanol is C21H29NO3.
What is the molecular weight of Hydroxybutorphanol?
The molecular weight of Hydroxybutorphanol is 343.21 g/mol.
Where can I buy Hydroxybutorphanol?
You can request a quote for Hydroxybutorphanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxybutorphanol?
Yes, KEHONG BIO provides custom synthesis services for Hydroxybutorphanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.