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7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole
TL;DR: 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole (CAS 216218-91-6) is a chemical compound with molecular formula C15H11N3O and molecular weight 249.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole
Also Known As: 7-methyl-6-phenyl-6H-[1,2,5]oxadiazolo[3,4-e]indole, 7-methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole, 6-phenyl-7-methyl-6h-pyrrolo[3,2-e]-2,1,3-benzoxadiazole
| Molecular Formula | C15H11N3O |
|---|---|
| Molecular Weight | 249.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 43.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.09021 |
| Heavy Atoms | 19 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 216218-91-6 |
|---|---|
| SMILES | CC1=CC2=C(N1C3=CC=CC=C3)C=CC4=NON=C42 |
| InChIKey | LVQIYCDNKKYDRW-UHFFFAOYSA-N |
Product Overview
7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole (CAS 216218-91-6), with molecular formula C15H11N3O and molecular weight 249.09 g/mol. IUPAC: 7-methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole.
Chemical Property Profile of 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole
Property Insights of 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole
The XLogP value of 3.3 indicates that 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.9 Ų, 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole has 0 hydrogen bond donor(s) and 3 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 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole?
The CAS number of 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole is 216218-91-6.
What is the molecular formula of 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole?
The molecular formula of 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole is C15H11N3O.
What is the molecular weight of 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole?
The molecular weight of 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole is 249.09 g/mol.
Where can I buy 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole?
You can request a quote for 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 7-Methyl-6-phenylpyrrolo[2,3-g][2,1,3]benzoxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.