N-{3-[benzyl(butyl)amino]propyl}-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-{3-[benzyl(butyl)amino]propyl}-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-{3-[benzyl(butyl)amino]propyl}-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
| Compound ID: | C700-0204 |
| Compound Name: | N-{3-[benzyl(butyl)amino]propyl}-2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
| Molecular Weight: | 570.75 |
| Molecular Formula: | C30 H42 N4 O5 S |
| Smiles: | CCCCN(CCCNC(CN1C(COc2ccc(cc12)S(N1CCC(C)CC1)(=O)=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7807 |
| logD: | 2.1616 |
| logSw: | -3.7672 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.032 |
| InChI Key: | AAYVOKWNNKZKMG-UHFFFAOYSA-N |