![3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide structure](/static/products/883/883294-55-1.png)
3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide
TL;DR: 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide (CAS 883294-55-1) is a chemical compound with molecular formula C13H17N5O and molecular weight 259.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-N-[3-(tetrazol-1-yl)phenyl]butanamide
Also Known As: 3,3-dimethyl-N-[3-(tetrazol-1-yl)phenyl]butanamide, 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide, N-(3-(1H-tetrazol-1-yl)phenyl)-3,3-dimethylbutanamide
| Molecular Formula | C13H17N5O |
|---|---|
| Molecular Weight | 259.14 g/mol |
| LogP | 2.037 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.1433 |
| Heavy Atoms | 19 |
| Complexity | 556.6626 |
Chemical Identifiers
| CAS Number | 883294-55-1 |
|---|---|
| SMILES | CC(C)(C)CC(=O)NC1=CC(=CC=C1)N2C=NN=N2 |
Product Overview
3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide (CAS 883294-55-1), with molecular formula C13H17N5O and molecular weight 259.14 g/mol. IUPAC: 3,3-dimethyl-N-[3-(tetrazol-1-yl)phenyl]butanamide.
Chemical Property Profile of 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide
Property Insights of 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide
The XLogP value of 2.037 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide. Following Lipinski's Rule of Five, 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide 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 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide?
The CAS number of 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide is 883294-55-1.
What is the molecular formula of 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide?
The molecular formula of 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide is C13H17N5O.
What is the molecular weight of 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide?
The molecular weight of 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide is 259.14 g/mol.
Where can I buy 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide?
You can request a quote for 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for 3,3-dimethyl-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.