1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole
TL;DR: 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole (CAS 838882-72-7) is a chemical compound with molecular formula C15H21N3O2S and molecular weight 307.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole
Also Known As: 1-(azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole, 1-(1-azepanylsulfonyl)-5,6-dimethyl-1H-benzimidazole, VU0508663-1, AP-124/43382881, 1-(azepan-1-ylsulfonyl)-5,6-dimethyl-1H-benzo[d]imidazole
| Molecular Formula | C15H21N3O2S |
|---|---|
| Molecular Weight | 307.14 g/mol |
| LogP | 2.62204 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.13544 |
| Heavy Atoms | 21 |
| Complexity | 756.5619 |
Chemical Identifiers
| CAS Number | 838882-72-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C=N2)S(=O)(=O)N3CCCCCC3 |
Product Overview
1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole (CAS 838882-72-7), with molecular formula C15H21N3O2S and molecular weight 307.14 g/mol. IUPAC: 1-(azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole.
Chemical Property Profile of 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole
Property Insights of 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole
The XLogP value of 2.62204 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole. With a topological polar surface area (TPSA) of 55.2 Ų, 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole 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-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole?
The CAS number of 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole is 838882-72-7.
What is the molecular formula of 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole?
The molecular formula of 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole is C15H21N3O2S.
What is the molecular weight of 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole?
The molecular weight of 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole is 307.14 g/mol.
Where can I buy 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole?
You can request a quote for 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(Azepan-1-ylsulfonyl)-5,6-dimethylbenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.