![4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide structure](/static/products/114/1144486-53-2.webp)
4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide
TL;DR: 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide (CAS 1144486-53-2) is a chemical compound with molecular formula C16H13N5O3 and molecular weight 323.10184 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]benzamide
Also Known As: 4-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)benzamide, 4-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]benzamide, 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide
Technical Specifications
| Molecular Formula | C16H13N5O3 |
| Molecular Weight | 323.10184 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.10184 Da |
| Heavy Atoms | 24 |
| Complexity | 542.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(N=N2)CC(=O)NC3=CC=C(C=C3)C(=O)N |
| InChIKey | NDEZLCREBKNQIP-UHFFFAOYSA-N |
Chemical Property Profile of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide
Property Insights of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide. Following Lipinski's Rule of Five, 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide?
The CAS number of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide is 1144486-53-2.
What is the molecular formula of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide?
The molecular formula of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide is C16H13N5O3.
What is the molecular weight of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide?
The molecular weight of 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide is 323.10184 g/mol.
Where can I buy 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide?
You can request a quote for 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide?
Yes, CoreyChem provides custom synthesis services for 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.