starbld0006137
TL;DR: starbld0006137 (CAS 850471-40-8) is a chemical compound with molecular formula C17H22N6OS and molecular weight 358.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-cyano-3-methylbutan-2-yl)-2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanylacetamide
Also Known As: starbld0006137, N-(1-cyano-1,2-dimethylpropyl)-2-{[1-(2,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]sulfanyl}acetamide, N-(2-Cyano-3-methylbutan-2-yl)-2-((1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl)thio)acetamide, N-(2-cyano-3-methylbutan-2-yl)-2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanylacetamide
| Molecular Formula | C17H22N6OS |
|---|---|
| Molecular Weight | 358.16 g/mol |
| LogP | 2.42572 |
| Topological Polar Surface Area | 96.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.1576 |
| Heavy Atoms | 25 |
| Complexity | 809.70966 |
Chemical Identifiers
| CAS Number | 850471-40-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NC(C)(C#N)C(C)C)C |
Product Overview
starbld0006137 (CAS 850471-40-8), with molecular formula C17H22N6OS and molecular weight 358.16 g/mol. IUPAC: N-(2-cyano-3-methylbutan-2-yl)-2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanylacetamide.
Chemical Property Profile of starbld0006137
Property Insights of starbld0006137
The XLogP value of 2.42572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for starbld0006137. The TPSA of 96.49 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0006137. Following Lipinski's Rule of Five, starbld0006137 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 starbld0006137?
The CAS number of starbld0006137 is 850471-40-8.
What is the molecular formula of starbld0006137?
The molecular formula of starbld0006137 is C17H22N6OS.
What is the molecular weight of starbld0006137?
The molecular weight of starbld0006137 is 358.16 g/mol.
Where can I buy starbld0006137?
You can request a quote for starbld0006137 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0006137?
Yes, KEHONG BIO provides custom synthesis services for starbld0006137 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.