TL;DR: 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one (CAS 102339-04-8) is a chemical compound with molecular formula C17H14N2O and molecular weight 262.11063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,6-diphenyl-5,6-diazaspiro[2.4]hept-4-en-7-one
Also Known As: 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one, 5,7-Diphenyl-5,6-diazaspiro[2.4]hept-6-en-4-one, 4,6-diphenyl-5,6-diazaspiro[2.4]hept-4-en-7-one, 5,6-Diazaspiro[2.4]hept-6-en-4-one,5,7-diphenyl-, 5,6-DIAZASPIRO(2.4)HEPT-6-EN-4-ONE, 5,7-DIPHENYL-
| Molecular Formula | C17H14N2O |
| Molecular Weight | 262.11063 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.11063 Da |
| Heavy Atoms | 20 |
| Complexity | 426.0 |
| SMILES | C1CC12C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | UAINZYUPUWLBEG-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one is 102339-04-8.
The molecular formula of 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one is C17H14N2O.
The molecular weight of 5,7-Diphenyl-5,6-diazaspiro(2.4)hept-6-en-4-one is 262.11063 g/mol.
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