![3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one structure](/static/products/117/1173680-49-3.webp)
3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one
TL;DR: 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one (CAS 1173680-49-3) is a chemical compound with molecular formula C24H28N4O2 and molecular weight 404.22122 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one
Also Known As: 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one, (S)-3-(1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl)benzo[d][1,2,3]triazin-4(3H)-one, 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Technical Specifications
| Molecular Formula | C24H28N4O2 |
| Molecular Weight | 404.22122 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 65.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.22122 Da |
| Heavy Atoms | 30 |
| Complexity | 635.0 |
| SMILES | CC(C)[C@@H](C(=O)N1CCC(CC1)CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=N3 |
| InChIKey | CPCAZMJEGJLCSV-QFIPXVFZSA-N |
Chemical Property Profile of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one
Property Insights of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one
The XLogP value of 5.2 indicates that 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one. Following Lipinski's Rule of Five, 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one?
The CAS number of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one is 1173680-49-3.
What is the molecular formula of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one?
The molecular formula of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one is C24H28N4O2.
What is the molecular weight of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one?
The molecular weight of 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one is 404.22122 g/mol.
Where can I buy 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one?
You can request a quote for 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one?
Yes, CoreyChem provides custom synthesis services for 3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.