TL;DR: 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one (CAS 153824-55-6) is a chemical compound with molecular formula C18H12N2O2 and molecular weight 288.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-4-phenyliminobenzo[f][1,3]benzoxazol-9-one
Also Known As: 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one, Naphth[2, 2-methyl-4-(phenylimino)-, 2-methyl-4-phenyliminobenzo[f][1,3]benzoxazol-9-one, NCI60_017571, (Z)-2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9(4H)-one
| Molecular Formula | C18H12N2O2 |
| Molecular Weight | 288.08987 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 55.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.08987 Da |
| Heavy Atoms | 22 |
| Complexity | 470.0 |
| SMILES | CC1=NC2=C(O1)C(=O)C3=CC=CC=C3C2=NC4=CC=CC=C4 |
| InChIKey | UPEHKUQHXSSQQA-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.5 Ų, 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one is 153824-55-6.
The molecular formula of 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one is C18H12N2O2.
The molecular weight of 2-Methyl-4-(phenylimino)naphth(2,3-d)oxazol-9-one is 288.08987 g/mol.
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