3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one
TL;DR: 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one (CAS 694517-39-0) is a chemical compound with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzylbenzimidazol-2-yl)sulfanyloxolan-2-one
Also Known As: 3-(1-benzylbenzimidazol-2-yl)sulfanyloxolan-2-one, BAS 06982638, AP-853/42160592, 3-[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]dihydro-2(3H)-furanone, 3-[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]dihydrofuran-2(3H)-one
| Molecular Formula | C18H16N2O2S |
|---|---|
| Molecular Weight | 324.09 g/mol |
| LogP | 3.4922 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.09326 |
| Heavy Atoms | 23 |
| Complexity | 844.6087 |
Chemical Identifiers
| CAS Number | 694517-39-0 |
|---|---|
| SMILES | C1COC(=O)C1SC2=NC3=CC=CC=C3N2CC4=CC=CC=C4 |
Product Overview
3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one (CAS 694517-39-0), with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol. IUPAC: 3-(1-benzylbenzimidazol-2-yl)sulfanyloxolan-2-one.
Chemical Property Profile of 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one
Property Insights of 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one
The XLogP value of 3.4922 indicates that 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one has 0 hydrogen bond donor(s) and 4 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 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one?
The CAS number of 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one is 694517-39-0.
What is the molecular formula of 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one?
The molecular formula of 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one is C18H16N2O2S.
What is the molecular weight of 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one?
The molecular weight of 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one is 324.09 g/mol.
Where can I buy 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one?
You can request a quote for 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Benzylbenzimidazol-2-yl)sulfanyloxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.