2-{1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]piperidin-4-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide
Chemical Structure Depiction of
2-{1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]piperidin-4-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide
2-{1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]piperidin-4-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide
Compound characteristics
| Compound ID: | L799-2533 |
| Compound Name: | 2-{1-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]piperidin-4-yl}-N-{3-[(propan-2-yl)oxy]propyl}acetamide |
| Molecular Weight: | 481.61 |
| Molecular Formula: | C23 H35 N3 O6 S |
| Smiles: | CC(C)N1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)CC(NCCCOC(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3987 |
| logD: | 2.3987 |
| logSw: | -2.9641 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.284 |
| InChI Key: | VABUAUHFTNFGPB-UHFFFAOYSA-N |