5-methyl-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
5-methyl-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one
5-methyl-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 8009-8607 |
| Compound Name: | 5-methyl-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 282.25 |
| Molecular Formula: | C15 H10 N2 O4 |
| Smiles: | Cc1cccc2c1C(=O)OC(c1cccc(c1)[N+]([O-])=O)=N2 |
| Stereo: | ACHIRAL |
| logP: | 2.8871 |
| logD: | 2.8871 |
| logSw: | -3.4859 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.567 |
| InChI Key: | JKGJOOSTPLDFAJ-UHFFFAOYSA-N |