N-丙基-1,2,4-苯并三嗪-3-乙酰胺
TL;DR: N-丙基-1,2,4-苯并三嗪-3-乙酰胺 (CAS 80722-72-1) is a chemical compound with molecular formula C12H14N4O and molecular weight 230.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-丙基-1,2,4-苯并三嗪-3-乙酰胺
2-(1,2,4-benzotriazin-3-yl)-N-propylacetamide
Also Known As: N-Propyl-1,2,4-benzotriazine-3-acetamide, 2-(1,2,4-benzotriazin-3-yl)-N-propylacetamide, 1,2,4-BENZOTRIAZINE-3-ACETAMIDE, N-PROPYL-, BRN 5746435, RefChem:214901
| Molecular Formula | C12H14N4O |
|---|---|
| Molecular Weight | 230.12 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.11676 |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 80722-72-1 |
|---|---|
| SMILES | CCCNC(=O)CC1=NC2=CC=CC=C2N=N1 |
| InChIKey | WBVJMTOKNDAGCR-UHFFFAOYSA-N |
Product Overview
N-丙基-1,2,4-苯并三嗪-3-乙酰胺 (CAS 80722-72-1), with molecular formula C12H14N4O and molecular weight 230.12 g/mol. IUPAC: 2-(1,2,4-benzotriazin-3-yl)-N-propylacetamide.
Chemical Property Profile of N-丙基-1,2,4-苯并三嗪-3-乙酰胺
Property Insights of N-丙基-1,2,4-苯并三嗪-3-乙酰胺
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-丙基-1,2,4-苯并三嗪-3-乙酰胺. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-丙基-1,2,4-苯并三嗪-3-乙酰胺. Following Lipinski's Rule of Five, N-丙基-1,2,4-苯并三嗪-3-乙酰胺 has 1 hydrogen bond donor(s) and 4 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 N-丙基-1,2,4-苯并三嗪-3-乙酰胺?
The CAS number of N-丙基-1,2,4-苯并三嗪-3-乙酰胺 is 80722-72-1.
What is the molecular formula of N-丙基-1,2,4-苯并三嗪-3-乙酰胺?
The molecular formula of N-丙基-1,2,4-苯并三嗪-3-乙酰胺 is C12H14N4O.
What is the molecular weight of N-丙基-1,2,4-苯并三嗪-3-乙酰胺?
The molecular weight of N-丙基-1,2,4-苯并三嗪-3-乙酰胺 is 230.12 g/mol.
Where can I buy N-丙基-1,2,4-苯并三嗪-3-乙酰胺?
You can request a quote for N-丙基-1,2,4-苯并三嗪-3-乙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-丙基-1,2,4-苯并三嗪-3-乙酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-丙基-1,2,4-苯并三嗪-3-乙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.