N-环己基-1H-苯并咪唑-2-亚磺酰胺
TL;DR: N-环己基-1H-苯并咪唑-2-亚磺酰胺 (CAS 68406-57-5) is a chemical compound with molecular formula C13H17N3S and molecular weight 247.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-环己基-1H-苯并咪唑-2-亚磺酰胺
N-(1H-benzimidazol-2-ylsulfanyl)cyclohexanamine
Also Known As: 1H-Benzimidazole-2-sulfenamide, N-cyclohexyl-, N-(1H-benzimidazol-2-ylsulfanyl)cyclohexanamine, J1.593.473E, N-CYCLOHEXYL-1H-BENZIMIDAZOLE-2-SULFENAMIDE, N-CYCLOHEXYL-1H-BENZOIMIDAZOLE-2-SULFENAMIDE
| Molecular Formula | C13H17N3S |
|---|---|
| Molecular Weight | 247.11 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.11432 |
| Heavy Atoms | 17 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 68406-57-5 |
|---|---|
| SMILES | C1CCC(CC1)NSC2=NC3=CC=CC=C3N2 |
| InChIKey | KCHOOFVJADCWQQ-UHFFFAOYSA-N |
Product Overview
N-环己基-1H-苯并咪唑-2-亚磺酰胺 (CAS 68406-57-5), with molecular formula C13H17N3S and molecular weight 247.11 g/mol. IUPAC: N-(1H-benzimidazol-2-ylsulfanyl)cyclohexanamine.
Chemical Property Profile of N-环己基-1H-苯并咪唑-2-亚磺酰胺
Property Insights of N-环己基-1H-苯并咪唑-2-亚磺酰胺
The XLogP value of 3.3 indicates that N-环己基-1H-苯并咪唑-2-亚磺酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-环己基-1H-苯并咪唑-2-亚磺酰胺. Following Lipinski's Rule of Five, N-环己基-1H-苯并咪唑-2-亚磺酰胺 has 2 hydrogen bond donor(s) and 3 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-环己基-1H-苯并咪唑-2-亚磺酰胺?
The CAS number of N-环己基-1H-苯并咪唑-2-亚磺酰胺 is 68406-57-5.
What is the molecular formula of N-环己基-1H-苯并咪唑-2-亚磺酰胺?
The molecular formula of N-环己基-1H-苯并咪唑-2-亚磺酰胺 is C13H17N3S.
What is the molecular weight of N-环己基-1H-苯并咪唑-2-亚磺酰胺?
The molecular weight of N-环己基-1H-苯并咪唑-2-亚磺酰胺 is 247.11 g/mol.
Where can I buy N-环己基-1H-苯并咪唑-2-亚磺酰胺?
You can request a quote for N-环己基-1H-苯并咪唑-2-亚磺酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-环己基-1H-苯并咪唑-2-亚磺酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-环己基-1H-苯并咪唑-2-亚磺酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.