1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(oxolan-2-yl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(oxolan-2-yl)methyl]piperidine-4-carboxamide
1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(oxolan-2-yl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F184-2719 |
| Compound Name: | 1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(oxolan-2-yl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C21 H29 N3 O6 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCC(CC1)C(NCC1CCCO1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.9254 |
| logD: | 0.9248 |
| logSw: | -2.2383 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.626 |
| InChI Key: | JGNVKTXYDMICQG-UHFFFAOYSA-N |