ethyl 3-{2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamido}benzoate
ethyl 3-{2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | K783-6944 |
| Compound Name: | ethyl 3-{2-[6-(4-methylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamido}benzoate |
| Molecular Weight: | 515.58 |
| Molecular Formula: | C25 H29 N3 O7 S |
| Smiles: | CCOC(c1cccc(c1)NC(CN1C(COc2ccc(cc12)S(N1CCC(C)CC1)(=O)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8307 |
| logD: | 3.8307 |
| logSw: | -3.9886 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.682 |
| InChI Key: | NGVQPQJAEPJHPF-UHFFFAOYSA-N |