N-allyl levallorphan-bromide
TL;DR: N-allyl levallorphan-bromide (CAS 63868-47-3) is a chemical compound with molecular formula C22H30BrNO and molecular weight 403.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9R,10R)-17,17-bis(prop-2-enyl)-17-azoniatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol bromide
Also Known As: N-allyl Levallorphan-bromide, CM 32191, (-)-N,N-Diallyl-3-hydroxymorphinium bromide, Morphinium, N,N-diallyl-3-hydroxy-, bromide, (-)-, Morphinium,N,N-diallyl-3-hydroxy-,bromide,(-)
| Molecular Formula | C22H30BrNO |
|---|---|
| Molecular Weight | 403.15 g/mol |
| LogP | 1.3414 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.1511 |
| Heavy Atoms | 25 |
| Complexity | 659.9911 |
Chemical Identifiers
| CAS Number | 63868-47-3 |
|---|---|
| SMILES | C=CC[N+]1(CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O)CC=C.[Br-] |
Product Overview
N-allyl levallorphan-bromide (CAS 63868-47-3), with molecular formula C22H30BrNO and molecular weight 403.15 g/mol. IUPAC: (1R,9R,10R)-17,17-bis(prop-2-enyl)-17-azoniatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol bromide.
Chemical Property Profile of N-allyl levallorphan-bromide
Property Insights of N-allyl levallorphan-bromide
The XLogP value of 1.3414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl levallorphan-bromide. With a topological polar surface area (TPSA) of 20.23 Ų, N-allyl levallorphan-bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl levallorphan-bromide has 1 hydrogen bond donor(s) and 1 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 N-allyl levallorphan-bromide?
The CAS number of N-allyl levallorphan-bromide is 63868-47-3.
What is the molecular formula of N-allyl levallorphan-bromide?
The molecular formula of N-allyl levallorphan-bromide is C22H30BrNO.
What is the molecular weight of N-allyl levallorphan-bromide?
The molecular weight of N-allyl levallorphan-bromide is 403.15 g/mol.
Where can I buy N-allyl levallorphan-bromide?
You can request a quote for N-allyl levallorphan-bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl levallorphan-bromide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl levallorphan-bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.