Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide
TL;DR: Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide (CAS 165611-04-1) is a chemical compound with molecular formula C12H8N4O3 and molecular weight 256.05963 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-oxido-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidin-6-ium-3-carboxamide
Also Known As: Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide, 7-Phenylisoxazolo(4,5-d)pyrimidine-3-carboxamide 6-oxide, 3-Carbamido-7-phenylisoxazolo(4,5-d)pyrimidine 6-N-oxide, 6-oxido-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidin-6-ium-3-carboxamide, 3-CARBAMOYL-7-PHENYL-[1,2]OXAZOLO[4,5-D]PYRIMIDIN-6-IUM-6-OLATE
Technical Specifications
| Molecular Formula | C12H8N4O3 |
| Molecular Weight | 256.05963 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.05963 Da |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
| SMILES | C1=CC=C(C=C1)C2=[N+](C=NC3=C2ON=C3C(=O)N)[O-] |
| InChIKey | FZKFKOYCTUYKFC-UHFFFAOYSA-N |
Chemical Property Profile of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide
Property Insights of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide. Following Lipinski's Rule of Five, Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide?
The CAS number of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide is 165611-04-1.
What is the molecular formula of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide?
The molecular formula of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide is C12H8N4O3.
What is the molecular weight of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide?
The molecular weight of Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide is 256.05963 g/mol.
Where can I buy Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide?
You can request a quote for Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide?
Yes, CoreyChem provides custom synthesis services for Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 7-phenyl-, 6-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.