quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate
TL;DR: quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate (CAS 692761-91-4) is a chemical compound with molecular formula C16H11N3O4S and molecular weight 341.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
quinolin-8-yl 2-oxo-1,3-dihydrobenzimidazole-5-sulfonate
Also Known As: quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate, quinolin-8-yl 2-oxo-1,3-dihydrobenzimidazole-5-sulfonate
| Molecular Formula | C16H11N3O4S |
|---|---|
| Molecular Weight | 341.05 g/mol |
| LogP | 2.1721 |
| Topological Polar Surface Area | 104.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.04703 |
| Heavy Atoms | 24 |
| Complexity | 1219.5273 |
Chemical Identifiers
| CAS Number | 692761-91-4 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)OS(=O)(=O)C3=CC4=C(C=C3)NC(=O)N4)N=CC=C2 |
Product Overview
quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate (CAS 692761-91-4), with molecular formula C16H11N3O4S and molecular weight 341.05 g/mol. IUPAC: quinolin-8-yl 2-oxo-1,3-dihydrobenzimidazole-5-sulfonate.
Chemical Property Profile of quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate
Property Insights of quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate
The XLogP value of 2.1721 suggests moderate lipophilicity, balancing water solubility and membrane permeability for quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate. The TPSA of 104.91 Ų falls within the moderate polarity range, balancing permeability and solubility for quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate. Following Lipinski's Rule of Five, quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate has 2 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 quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate?
The CAS number of quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate is 692761-91-4.
What is the molecular formula of quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate?
The molecular formula of quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate is C16H11N3O4S.
What is the molecular weight of quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate?
The molecular weight of quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate is 341.05 g/mol.
Where can I buy quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate?
You can request a quote for quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for quinolin-8-yl 2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.