1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E557-2345 |
| Compound Name: | 1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(3-fluorophenyl)piperidine-4-carboxamide |
| Molecular Weight: | 461.51 |
| Molecular Formula: | C22 H24 F N3 O5 S |
| Smiles: | CC(N1CCOc2ccc(cc12)S(N1CCC(CC1)C(Nc1cccc(c1)F)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3207 |
| logD: | 2.32 |
| logSw: | -2.9689 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.044 |
| InChI Key: | SONHXRPBPHLMEX-UHFFFAOYSA-N |