Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate
TL;DR: Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate (CAS 159325-86-7) is a chemical compound with molecular formula C12H11N3O4 and molecular weight 261.07495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 6-hydroxy-7-methylpyrrolo[2,3-g][2,1,3]benzoxadiazole-8-carboxylate
Also Known As: Maybridge4_003469, ethyl 6-HYDROXY-7-METHYL-6H-[1,2,5]OXADIAZOLO[3,4-E]INDOLE-8-CARBOXYLATE, ethyl 6-hydroxy-7-methylpyrrolo[2,3-g][2,1,3]benzoxadiazole-8-carboxylate, BRD-K99864379-001-01-7, ethyl 6-hydroxy-7-methyl-[1,2,5]oxadiazolo[3,4-e]indole-8-carboxylate
Technical Specifications
| Molecular Formula | C12H11N3O4 |
| Molecular Weight | 261.07495 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 90.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.07495 Da |
| Heavy Atoms | 19 |
| Complexity | 367.0 |
| SMILES | CCOC(=O)C1=C(N(C2=C1C3=NON=C3C=C2)O)C |
| InChIKey | WNYUNHCDFJJTNM-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate
Property Insights of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate. Following Lipinski's Rule of Five, Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate?
The CAS number of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate is 159325-86-7.
What is the molecular formula of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate?
The molecular formula of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate is C12H11N3O4.
What is the molecular weight of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate?
The molecular weight of Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate is 261.07495 g/mol.
Where can I buy Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate?
You can request a quote for Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 6-hydroxy-7-methyl-6H-pyrrolo(3,2-e)-2,1,3-benzoxadiazole-8-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.