6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F119-0939 |
| Compound Name: | 6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C28 H28 F N3 O3 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4996 |
| logD: | 4.4996 |
| logSw: | -4.3983 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.676 |
| InChI Key: | CHKVFOSXHNCBAN-UHFFFAOYSA-N |