N-(2-chloro-4-methylphenyl)-1-(2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-1-(2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
N-(2-chloro-4-methylphenyl)-1-(2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E216-0890 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-1-(2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C22 H24 Cl N3 O3 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(C1CCN(CC1)C(N1CCOc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9973 |
| logD: | 3.9964 |
| logSw: | -4.2845 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.702 |
| InChI Key: | PEKNEEAWQRUCCV-UHFFFAOYSA-N |