2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide
TL;DR: 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide (CAS 698989-32-1) is a chemical compound with molecular formula C16H21N5OS and molecular weight 331.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide
Also Known As: 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide, 2-[(1-benzyl-1H-tetrazol-5-yl)thio]-N-cyclohexylacetamide, AO-080/43378200, A3672/0155679, 2-[(1-benzyl-1H-tetrazol-5-yl)sulfanyl]-N-cyclohexylacetamide
| Molecular Formula | C16H21N5OS |
|---|---|
| Molecular Weight | 331.15 g/mol |
| LogP | 2.2624 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.14667 |
| Heavy Atoms | 23 |
| Complexity | 624.41064 |
Chemical Identifiers
| CAS Number | 698989-32-1 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)CSC2=NN=NN2CC3=CC=CC=C3 |
Product Overview
2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide (CAS 698989-32-1), with molecular formula C16H21N5OS and molecular weight 331.15 g/mol. IUPAC: 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide.
Chemical Property Profile of 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide
Property Insights of 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide
The XLogP value of 2.2624 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide. Following Lipinski's Rule of Five, 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide has 1 hydrogen bond donor(s) and 5 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-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide?
The CAS number of 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide is 698989-32-1.
What is the molecular formula of 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide?
The molecular formula of 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide is C16H21N5OS.
What is the molecular weight of 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide?
The molecular weight of 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide is 331.15 g/mol.
Where can I buy 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide?
You can request a quote for 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-benzyltetrazol-5-yl)sulfanyl-N-cyclohexylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.