ethyl 4-{[1-(2,1,3-benzoxadiazole-4-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-(2,1,3-benzoxadiazole-4-sulfonyl)piperidine-4-carbonyl]amino}benzoate
ethyl 4-{[1-(2,1,3-benzoxadiazole-4-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G940-0154 |
| Compound Name: | ethyl 4-{[1-(2,1,3-benzoxadiazole-4-sulfonyl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C21 H22 N4 O6 S |
| Smiles: | CCOC(c1ccc(cc1)NC(C1CCN(CC1)S(c1cccc2c1non2)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2909 |
| logD: | 3.2904 |
| logSw: | -3.3357 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.884 |
| InChI Key: | BDPMKBCZLFJZRR-UHFFFAOYSA-N |