TL;DR: Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl- (CAS 138188-02-0) is a chemical compound with molecular formula C18H13N3O3 and molecular weight 319.0957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(2-methoxyphenyl)-1-phenylpyrazolo[5,4-d][1,3]oxazin-4-one
Also Known As: Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl-, 6-(2-Methoxyphenyl)-1-phenylpyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4-one, 6-(2-Methoxyphenyl)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one, BRN 4820593
| Molecular Formula | C18H13N3O3 |
| Molecular Weight | 319.0957 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.0957 Da |
| Heavy Atoms | 24 |
| Complexity | 504.0 |
| SMILES | COC1=CC=CC=C1C2=NC3=C(C=NN3C4=CC=CC=C4)C(=O)O2 |
| InChIKey | YPKAMYSLKNIWCG-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl-. Following Lipinski's Rule of Five, Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl- is 138188-02-0.
The molecular formula of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl- is C18H13N3O3.
The molecular weight of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 6-(2-methoxyphenyl)-1-phenyl- is 319.0957 g/mol.
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