ethyl 4-[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]piperazine-1-carboxylate
ethyl 4-[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C648-0069 |
| Compound Name: | ethyl 4-[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 480.54 |
| Molecular Formula: | C21 H28 N4 O7 S |
| Smiles: | CCOC(N1CCN(CC1)C(C1CCCN(C1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0821 |
| logD: | 1.0821 |
| logSw: | -2.5248 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 94.177 |
| InChI Key: | UJCAQGZIMJDUGS-HNNXBMFYSA-N |