(2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
TL;DR: (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide (CAS 1173687-70-1) is a chemical compound with molecular formula C18H16N4O4 and molecular weight 352.11716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
Also Known As: (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide, (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide, (S)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamide
Technical Specifications
| Molecular Formula | C18H16N4O4 |
| Molecular Weight | 352.11716 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 92.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.11716 Da |
| Heavy Atoms | 26 |
| Complexity | 584.0 |
| SMILES | C[C@@H](C(=O)NC1=CC2=C(C=C1)OCCO2)N3C(=O)C4=CC=CC=C4N=N3 |
| InChIKey | VHBKSGMAVCIVLZ-NSHDSACASA-N |
Chemical Property Profile of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
Property Insights of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide. The TPSA of 92.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide. Following Lipinski's Rule of Five, (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide?
The CAS number of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide is 1173687-70-1.
What is the molecular formula of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide?
The molecular formula of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide is C18H16N4O4.
What is the molecular weight of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide?
The molecular weight of (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide is 352.11716 g/mol.
Where can I buy (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide?
You can request a quote for (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide?
Yes, CoreyChem provides custom synthesis services for (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.