1-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-3-carboxamide
1-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F184-3635 |
| Compound Name: | 1-(2-ethyl-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[2-(pyrrolidin-1-yl)ethyl]piperidine-3-carboxamide |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C23 H34 N4 O5 S |
| Smiles: | CCC1C(Nc2cc(C)c(cc2O1)S(N1CCCC(C1)C(NCCN1CCCC1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6181 |
| logD: | -0.6224 |
| logSw: | -2.3785 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.289 |
| InChI Key: | YMEIMIUISLFROL-UHFFFAOYSA-N |