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(1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide structure
Fine Chemical

(1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide

TL;DR: (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide (CAS 1212358-19-4) is a chemical compound with molecular formula C20H23N3O3 and molecular weight 353.17395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(1S,9R)-N-[(4-methoxyphenyl)methyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide

Also Known As: (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide

CAS Number
1212358-19-4
Molecular Formula
C20H23N3O3
Molecular Weight
353.17395 g/mol
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Technical Specifications

Molecular FormulaC20H23N3O3
Molecular Weight353.17395 g/mol
XLogP1.4
Topological Polar Surface Area (TPSA)61.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds3
Exact Mass353.17395 Da
Heavy Atoms26
Complexity622.0
SMILESCOC1=CC=C(C=C1)CNC(=O)N2C[C@@H]3C[C@@H](C2)C4=CC=CC(=O)N4C3
InChIKeyQLXLSBQEBNAKMO-HOTGVXAUSA-N

Chemical Property Profile of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide

XLogP
1.4
TPSA (Topological Polar Surface Area)
61.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
3
Heavy Atoms
26
Complexity
622.0
Exact Mass
353.17395
Monoisotopic Mass
353.17395
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide

The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide. Following Lipinski's Rule of Five, (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?

The CAS number of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide is 1212358-19-4.

What is the molecular formula of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?

The molecular formula of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide is C20H23N3O3.

What is the molecular weight of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?

The molecular weight of (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide is 353.17395 g/mol.

Where can I buy (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?

You can request a quote for (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?

Yes, CoreyChem provides custom synthesis services for (1S,5R)-N-(4-methoxybenzyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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