![(1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one structure](/static/products/308/308280-37-7.png)
(1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
TL;DR: (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one (CAS 308280-37-7) is a chemical compound with molecular formula C20H22N2O3 and molecular weight 338.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9R)-11-[2-(4-methoxyphenyl)acetyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
Also Known As: (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
| Molecular Formula | C20H22N2O3 |
|---|---|
| Molecular Weight | 338.16 g/mol |
| LogP | 2.0453 |
| Topological Polar Surface Area | 51.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.16306 |
| Heavy Atoms | 25 |
| Complexity | 840.76495 |
Chemical Identifiers
| CAS Number | 308280-37-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC(=O)N2C[C@H]3C[C@@H](C2)C4=CC=CC(=O)N4C3 |
Product Overview
(1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one (CAS 308280-37-7), with molecular formula C20H22N2O3 and molecular weight 338.16 g/mol. IUPAC: (1S,9R)-11-[2-(4-methoxyphenyl)acetyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one.
Chemical Property Profile of (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Property Insights of (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
The XLogP value of 2.0453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one. With a topological polar surface area (TPSA) of 51.54 Ų, (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one has 0 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 (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
The CAS number of (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one is 308280-37-7.
What is the molecular formula of (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
The molecular formula of (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one is C20H22N2O3.
What is the molecular weight of (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
The molecular weight of (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one is 338.16 g/mol.
Where can I buy (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
You can request a quote for (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one?
Yes, KEHONG BIO provides custom synthesis services for (1S,5R)-3-[(4-methoxyphenyl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.