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2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole
TL;DR: 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole (CAS 328964-94-9) is a chemical compound with molecular formula C16H13N3OS and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole
Also Known As: BAS 01322617, 2-[(1-methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole, 1,3-benzoxazol-2-yl (1-methyl-1H-benzimidazol-2-yl)methyl sulfide, F0430-0100, 2-{[(1-methyl-1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole
| Molecular Formula | C16H13N3OS |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.07794 |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 328964-94-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1CSC3=NC4=CC=CC=C4O3 |
| InChIKey | FPVNWVKORQADIK-UHFFFAOYSA-N |
Product Overview
2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole (CAS 328964-94-9), with molecular formula C16H13N3OS and molecular weight 295.08 g/mol. IUPAC: 2-[(1-methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole.
Chemical Property Profile of 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole
Property Insights of 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole
The XLogP value of 3.7 indicates that 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole. Following Lipinski's Rule of Five, 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole 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 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole?
The CAS number of 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole is 328964-94-9.
What is the molecular formula of 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole?
The molecular formula of 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole is C16H13N3OS.
What is the molecular weight of 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole?
The molecular weight of 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole is 295.08 g/mol.
Where can I buy 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole?
You can request a quote for 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1-Methylbenzimidazol-2-yl)methylsulfanyl]-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.