1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(pyrrolidin-1-yl)propyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(pyrrolidin-1-yl)propyl]piperidine-4-carboxamide
1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(pyrrolidin-1-yl)propyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F184-2858 |
| Compound Name: | 1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(pyrrolidin-1-yl)propyl]piperidine-4-carboxamide |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C23 H34 N4 O5 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCC(CC1)C(NCCCN1CCCC1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2278 |
| logD: | -1.8627 |
| logSw: | -2.2984 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.161 |
| InChI Key: | KCCDNGXZIFSFKG-QGZVFWFLSA-N |