N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
TL;DR: N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide (CAS 457077-48-4) is a chemical compound with molecular formula C12H15N5O3S and molecular weight 309.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
Also Known As: N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide, N-(3,4-dimethoxyphenyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
| Molecular Formula | C12H15N5O3S |
|---|---|
| Molecular Weight | 309.09 g/mol |
| LogP | 0.9581 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.08957 |
| Heavy Atoms | 21 |
| Complexity | 631.1055 |
Chemical Identifiers
| CAS Number | 457077-48-4 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC(=O)NC2=CC(=C(C=C2)OC)OC |
Product Overview
N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide (CAS 457077-48-4), with molecular formula C12H15N5O3S and molecular weight 309.09 g/mol. IUPAC: N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide.
Chemical Property Profile of N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
Property Insights of N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
The XLogP value of 0.9581 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide. Following Lipinski's Rule of Five, N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide 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-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
The CAS number of N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide is 457077-48-4.
What is the molecular formula of N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
The molecular formula of N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide is C12H15N5O3S.
What is the molecular weight of N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
The molecular weight of N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide is 309.09 g/mol.
Where can I buy N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
You can request a quote for N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dimethoxyphenyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.