Morphine 6-butyrate
TL;DR: Morphine 6-butyrate (CAS 66641-02-9) is a chemical compound with molecular formula C21H25NO4 and molecular weight 355.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4R,4aR,7S,7aR,12bS)-9-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] butanoate
Also Known As: Morphine 6-butyrate, O6-Monobutionylmorphine, 3-Hydroxy-17-methyl-5alpha-7,8-didehydro-4,5-epoxymorphinan-6alpha-yl butanoate
| Molecular Formula | C21H25NO4 |
|---|---|
| Molecular Weight | 355.18 g/mol |
| LogP | 2.5491 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.17834 |
| Heavy Atoms | 26 |
| Complexity | 803.446 |
Chemical Identifiers
| CAS Number | 66641-02-9 |
|---|---|
| SMILES | CCCC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3C |
Product Overview
Morphine 6-butyrate (CAS 66641-02-9), with molecular formula C21H25NO4 and molecular weight 355.18 g/mol. IUPAC: [(4R,4aR,7S,7aR,12bS)-9-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] butanoate.
Chemical Property Profile of Morphine 6-butyrate
Property Insights of Morphine 6-butyrate
The XLogP value of 2.5491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Morphine 6-butyrate. With a topological polar surface area (TPSA) of 59.0 Ų, Morphine 6-butyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Morphine 6-butyrate has 1 hydrogen bond donor(s) and 5 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 Morphine 6-butyrate?
The CAS number of Morphine 6-butyrate is 66641-02-9.
What is the molecular formula of Morphine 6-butyrate?
The molecular formula of Morphine 6-butyrate is C21H25NO4.
What is the molecular weight of Morphine 6-butyrate?
The molecular weight of Morphine 6-butyrate is 355.18 g/mol.
Where can I buy Morphine 6-butyrate?
You can request a quote for Morphine 6-butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Morphine 6-butyrate?
Yes, KEHONG BIO provides custom synthesis services for Morphine 6-butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.