2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole
TL;DR: 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole (CAS 63197-61-5) is a chemical compound with molecular formula C17H17N3O3S and molecular weight 343.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-phenylmethanone
Also Known As: EINECS 263-995-2, 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole, (2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-phenylmethanone, 1-isopropylsulfonyl-2-amino-6-benzoylbenzimidazole, 2-amino-6-benzoyl-1-[sulphonyl]-1h-benzimidazole
| Molecular Formula | C17H17N3O3S |
|---|---|
| Molecular Weight | 343.10 g/mol |
| LogP | 2.4358 |
| Topological Polar Surface Area | 95.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.09906 |
| Heavy Atoms | 24 |
| Complexity | 1021.9203 |
Chemical Identifiers
| CAS Number | 63197-61-5 |
|---|---|
| SMILES | CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C(=O)C3=CC=CC=C3)N=C1N |
Product Overview
2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole (CAS 63197-61-5), with molecular formula C17H17N3O3S and molecular weight 343.10 g/mol. IUPAC: (2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-phenylmethanone.
Chemical Property Profile of 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole
Property Insights of 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole
The XLogP value of 2.4358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole. The TPSA of 95.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole. Following Lipinski's Rule of Five, 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole has 1 hydrogen bond donor(s) and 5 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 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole?
The CAS number of 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole is 63197-61-5.
What is the molecular formula of 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole?
The molecular formula of 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole is C17H17N3O3S.
What is the molecular weight of 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole?
The molecular weight of 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole is 343.10 g/mol.
Where can I buy 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole?
You can request a quote for 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-6-benzoyl-1-((isopropyl)sulphonyl)-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.