N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide
TL;DR: N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide (CAS 125416-60-6) is a chemical compound with molecular formula C9H14N4OS and molecular weight 226.08884 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-cyclohexyl-5-sulfanylidene-1,2-dihydrotriazole-4-carboxamide
Also Known As: N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide, N-cyclohexyl-5-sulfanylidene-1,2-dihydrotriazole-4-carboxamide, N-cyclohexyl-5-thioxo-1,2-dihydrotriazole-4-carboxamide, N-Cyclohexyl-5-thioxo-2,5-dihydro-1H-1,2,3-triazole-4-carboxamide, N-cyclohexyl-5-sulfanylidene-1,2-dihydro-1,2,3-triazole-4-carboxamide
Technical Specifications
| Molecular Formula | C9H14N4OS |
| Molecular Weight | 226.08884 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 97.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.08884 Da |
| Heavy Atoms | 15 |
| Complexity | 309.0 |
| SMILES | C1CCC(CC1)NC(=O)C2=NNNC2=S |
| InChIKey | JRUIEVUSJMRVMQ-UHFFFAOYSA-N |
Chemical Property Profile of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide
Property Insights of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide. Following Lipinski's Rule of Five, N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide?
The CAS number of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide is 125416-60-6.
What is the molecular formula of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide?
The molecular formula of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide is C9H14N4OS.
What is the molecular weight of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide?
The molecular weight of N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide is 226.08884 g/mol.
Where can I buy N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide?
You can request a quote for N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide?
Yes, CoreyChem provides custom synthesis services for N-cyclohexyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.