N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
| Compound ID: | C534-0546 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C24 H36 N4 O5 S |
| Smiles: | CC1CC(C)CN(CCCNC(CN2C(COc3ccc(cc23)S(N2CCCC2)(=O)=O)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8051 |
| logD: | -0.7998 |
| logSw: | -2.7608 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.308 |
| InChI Key: | HVCSYSQDWVLKND-UHFFFAOYSA-N |