N-丁基苯并噻唑-2-亚磺酰胺
TL;DR: N-丁基苯并噻唑-2-亚磺酰胺 (CAS 32997-27-6) is a chemical compound with molecular formula C11H14N2S2 and molecular weight 238.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-丁基苯并噻唑-2-亚磺酰胺
N-(1,3-benzothiazol-2-ylsulfanyl)butan-1-amine
Also Known As: N-butylbenzothiazole-2-sulfenamide, Benzothiazole-2-sulfenamide, N-butyl-, N-butyl-benzothiazole-sulfenamide, 2-Benzothiazolesulfenamide, N-butyl-, N-Butyl-2-benzothiazolesulfenamide
| Molecular Formula | C11H14N2S2 |
|---|---|
| Molecular Weight | 238.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.05984 |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 32997-27-6 |
|---|---|
| SMILES | CCCCNSC1=NC2=CC=CC=C2S1 |
| InChIKey | AVLRJVPAKJCVMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-丁基苯并噻唑-2-亚磺酰胺 (CAS 32997-27-6), with molecular formula C11H14N2S2 and molecular weight 238.06 g/mol. IUPAC: N-(1,3-benzothiazol-2-ylsulfanyl)butan-1-amine.
Chemical Property Profile of N-丁基苯并噻唑-2-亚磺酰胺
Property Insights of N-丁基苯并噻唑-2-亚磺酰胺
The XLogP value of 3.7 indicates that N-丁基苯并噻唑-2-亚磺酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-丁基苯并噻唑-2-亚磺酰胺. Following Lipinski's Rule of Five, N-丁基苯并噻唑-2-亚磺酰胺 has 1 hydrogen bond donor(s) and 4 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-丁基苯并噻唑-2-亚磺酰胺?
The CAS number of N-丁基苯并噻唑-2-亚磺酰胺 is 32997-27-6.
What is the molecular formula of N-丁基苯并噻唑-2-亚磺酰胺?
The molecular formula of N-丁基苯并噻唑-2-亚磺酰胺 is C11H14N2S2.
What is the molecular weight of N-丁基苯并噻唑-2-亚磺酰胺?
The molecular weight of N-丁基苯并噻唑-2-亚磺酰胺 is 238.06 g/mol.
Where can I buy N-丁基苯并噻唑-2-亚磺酰胺?
You can request a quote for N-丁基苯并噻唑-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-丁基苯并噻唑-2-亚磺酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-丁基苯并噻唑-2-亚磺酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.