1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide
TL;DR: 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide (CAS 730997-79-2) is a chemical compound with molecular formula C16H24ClN3O2S and molecular weight 357.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-2-(chloromethyl)-N,N-diethylbenzimidazole-5-sulfonamide
Also Known As: 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide, 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-1,3-benzodiazole-5-sulfonamide, 1-butyl-2-(chloromethyl)-N,N-diethylbenzimidazole-5-sulfonamide, 1-butyl-2-(chloromethyl)-N,N-diethyl-benzoimidazole-5-sulfonamide
| Molecular Formula | C16H24ClN3O2S |
|---|---|
| Molecular Weight | 357.13 g/mol |
| LogP | 3.6057 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 357.12778 |
| Heavy Atoms | 23 |
| Complexity | 766.9685 |
Chemical Identifiers
| CAS Number | 730997-79-2 |
|---|---|
| SMILES | CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1CCl |
Product Overview
1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide (CAS 730997-79-2), with molecular formula C16H24ClN3O2S and molecular weight 357.13 g/mol. IUPAC: 1-butyl-2-(chloromethyl)-N,N-diethylbenzimidazole-5-sulfonamide.
Chemical Property Profile of 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide
Property Insights of 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide
The XLogP value of 3.6057 indicates that 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide has 0 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 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide?
The CAS number of 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide is 730997-79-2.
What is the molecular formula of 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide?
The molecular formula of 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide is C16H24ClN3O2S.
What is the molecular weight of 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide?
The molecular weight of 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide is 357.13 g/mol.
Where can I buy 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide?
You can request a quote for 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 1-butyl-2-(chloromethyl)-N,N-diethyl-1H-benzimidazole-5-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.