3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine
TL;DR: 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine (CAS 165611-03-0) is a chemical compound with molecular formula C18H20N6O2 and molecular weight 352.16476 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(4-methylpiperazin-1-yl)methyl]-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
Also Known As: 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine, Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 5-((4-methyl-1-piperazinyl)methyl)-7-phenyl-, 5-((4-Methyl-1-piperazinyl)methyl)-7-phenylisoxazolo(4,5-d)pyrimidine-3-carboxamide, 5-[(4-methylpiperazin-1-yl)methyl]-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide, 5-[(4-Methylpiperazin-1-yl)methyl]-7-phenyl[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
Technical Specifications
| Molecular Formula | C18H20N6O2 |
| Molecular Weight | 352.16476 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.16476 Da |
| Heavy Atoms | 26 |
| Complexity | 492.0 |
| SMILES | CN1CCN(CC1)CC2=NC3=C(C(=N2)C4=CC=CC=C4)ON=C3C(=O)N |
| InChIKey | UCWQCMNUCBHBDL-UHFFFAOYSA-N |
Chemical Property Profile of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine
Property Insights of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine. Following Lipinski's Rule of Five, 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine?
The CAS number of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine is 165611-03-0.
What is the molecular formula of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine?
The molecular formula of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine is C18H20N6O2.
What is the molecular weight of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine?
The molecular weight of 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine is 352.16476 g/mol.
Where can I buy 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine?
You can request a quote for 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine?
Yes, CoreyChem provides custom synthesis services for 3-Carbamido-5-(4'-methylpiperazinomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.