2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide
TL;DR: 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide (CAS 116460-70-9) is a chemical compound with molecular formula C13H17N3OS and molecular weight 263.10922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide
Also Known As: BAS 00671024, IDI1_020916, 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide, 2-benzimidazol-2-ylthio-N-(tert-butyl)acetamide, BRD-K00740732-001-01-9
Technical Specifications
| Molecular Formula | C13H17N3OS |
| Molecular Weight | 263.10922 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 83.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.10922 Da |
| Heavy Atoms | 18 |
| Complexity | 303.0 |
| SMILES | CC(C)(C)NC(=O)CSC1=NC2=CC=CC=C2N1 |
| InChIKey | ZCACJJQGOLCEKP-UHFFFAOYSA-N |
Chemical Property Profile of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide
Property Insights of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide 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
What is the CAS number of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide?
The CAS number of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide is 116460-70-9.
What is the molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide?
The molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide is C13H17N3OS.
What is the molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide?
The molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide is 263.10922 g/mol.
Where can I buy 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide?
You can request a quote for 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide?
Yes, CoreyChem provides custom synthesis services for 2-(1H-benzimidazol-2-ylsulfanyl)-N-tert-butylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.