![7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide structure](/static/products/132/132401-99-1.png)
7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide
TL;DR: 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide (CAS 132401-99-1) is a chemical compound with molecular formula C23H27N3OS and molecular weight 393.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide
Also Known As: 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide, (1R,5S)-7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide
| Molecular Formula | C23H27N3OS |
|---|---|
| Molecular Weight | 393.19 g/mol |
| LogP | 3.7965 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.18747 |
| Heavy Atoms | 28 |
| Complexity | 847.9309 |
Chemical Identifiers
| CAS Number | 132401-99-1 |
|---|---|
| SMILES | CC12CN(CC(C1=O)(CN(C2)C(=S)NC3=CC=CC=C3)C)CC4=CC=CC=C4 |
Product Overview
7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide (CAS 132401-99-1), with molecular formula C23H27N3OS and molecular weight 393.19 g/mol. IUPAC: 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide.
Chemical Property Profile of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide
Property Insights of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide
The XLogP value of 3.7965 indicates that 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide 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
Frequently Asked Questions
What is the CAS number of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide?
The CAS number of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide is 132401-99-1.
What is the molecular formula of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide?
The molecular formula of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide is C23H27N3OS.
What is the molecular weight of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide?
The molecular weight of 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide is 393.19 g/mol.
Where can I buy 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide?
You can request a quote for 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 7-benzyl-1,5-dimethyl-9-oxo-N-phenyl-3,7-diazabicyclo[3.3.1]nonane-3-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.