N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
| Compound ID: | C700-0805 |
| Compound Name: | N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
| Molecular Weight: | 568.74 |
| Molecular Formula: | C30 H40 N4 O5 S |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)N(CC(NCCN1CCC(CC1)Cc1ccccc1)=O)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.678 |
| logD: | 2.6978 |
| logSw: | -4.0677 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.803 |
| InChI Key: | YJAYAHSXPKMSND-UHFFFAOYSA-N |