![2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide structure](/static/products/3535/353510-44-8.webp)
2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide
TL;DR: 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide (CAS 353510-44-8) is a chemical compound with molecular formula C14H17N5O3 and molecular weight 303.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide
Also Known As: ChemDiv2_000887, BAS 02720965, AN-648/15101126, 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide, 2-(5-Benzo[1,3]dioxol-5-yl-tetrazol-2-yl)-N-tert-butyl-acetamide
| Molecular Formula | C14H17N5O3 |
|---|---|
| Molecular Weight | 303.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.13315 |
| Heavy Atoms | 22 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 353510-44-8 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CN1N=C(N=N1)C2=CC3=C(C=C2)OCO3 |
| InChIKey | DLTHHNMZTVGQOJ-UHFFFAOYSA-N |
Product Overview
2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide (CAS 353510-44-8), with molecular formula C14H17N5O3 and molecular weight 303.13 g/mol. IUPAC: 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide.
Chemical Property Profile of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide
Property Insights of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide. Following Lipinski's Rule of Five, 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide 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
Frequently Asked Questions
What is the CAS number of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide?
The CAS number of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide is 353510-44-8.
What is the molecular formula of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide?
The molecular formula of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide is C14H17N5O3.
What is the molecular weight of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide?
The molecular weight of 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide is 303.13 g/mol.
Where can I buy 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide?
You can request a quote for 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.