N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide
TL;DR: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide (CAS 728025-11-4) is a chemical compound with molecular formula C13H13N5O4 and molecular weight 303.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide
Also Known As: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide, A3855/0163702, N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1H-tetrazol-1-yl)propanamide, N-(6-ACETYL-2H-1,3-BENZODIOXOL-5-YL)-3-(1H-1,2,3,4-TETRAZOL-1-YL)PROPANAMIDE
| Molecular Formula | C13H13N5O4 |
|---|---|
| Molecular Weight | 303.10 g/mol |
| LogP | 0.6332 |
| Topological Polar Surface Area | 108.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.09674 |
| Heavy Atoms | 22 |
| Complexity | 713.4706 |
Chemical Identifiers
| CAS Number | 728025-11-4 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=C1NC(=O)CCN3C=NN=N3)OCO2 |
Product Overview
N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide (CAS 728025-11-4), with molecular formula C13H13N5O4 and molecular weight 303.10 g/mol. IUPAC: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide.
Chemical Property Profile of N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide
Property Insights of N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide
The XLogP value of 0.6332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide. The TPSA of 108.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide. Following Lipinski's Rule of Five, N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide has 1 hydrogen bond donor(s) and 7 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-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide?
The CAS number of N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide is 728025-11-4.
What is the molecular formula of N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide?
The molecular formula of N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide is C13H13N5O4.
What is the molecular weight of N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide?
The molecular weight of N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide is 303.10 g/mol.
Where can I buy N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide?
You can request a quote for N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(tetrazol-1-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.