![1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one structure](/static/products/5870/587010-50-2.webp)
1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one
TL;DR: 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one (CAS 587010-50-2) is a chemical compound with molecular formula C18H16N4OS and molecular weight 336.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-quinoxalin-2-ylsulfanylpropyl)-1H-benzimidazol-2-one
Also Known As: 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one, 1-(3-quinoxalin-2-ylthiopropyl)-3-hydrobenzimidazol-2-one, 3-(3-quinoxalin-2-ylsulfanylpropyl)-1H-benzimidazol-2-one, 1-(3-(quinoxalin-2-ylthio)propyl)-1H-benzo[d]imidazol-2(3H)-one, 1-(3-(Quinoxalin-2-ylthio)propyl)-1,3-dihydro-2H-benzo[d]imidazol-2-one
| Molecular Formula | C18H16N4OS |
|---|---|
| Molecular Weight | 336.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.1045 |
| Heavy Atoms | 24 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 587010-50-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=O)N2CCCSC3=NC4=CC=CC=C4N=C3 |
| InChIKey | NTCLOTIYKPORPK-UHFFFAOYSA-N |
Product Overview
1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one (CAS 587010-50-2), with molecular formula C18H16N4OS and molecular weight 336.10 g/mol. IUPAC: 3-(3-quinoxalin-2-ylsulfanylpropyl)-1H-benzimidazol-2-one.
Chemical Property Profile of 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one
Property Insights of 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one. Following Lipinski's Rule of Five, 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one has 1 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 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one?
The CAS number of 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one is 587010-50-2.
What is the molecular formula of 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one?
The molecular formula of 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one is C18H16N4OS.
What is the molecular weight of 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one?
The molecular weight of 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one is 336.10 g/mol.
Where can I buy 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one?
You can request a quote for 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(quinoxalin-2-ylsulfanyl)propyl]-1,3-dihydro-2H-benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.