ethyl 4-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoate
ethyl 4-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C648-0116 |
| Compound Name: | ethyl 4-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 487.53 |
| Molecular Formula: | C23 H25 N3 O7 S |
| Smiles: | CCOC(c1ccc(cc1)NC(C1CCCN(C1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5978 |
| logD: | 2.5959 |
| logSw: | -3.2318 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.593 |
| InChI Key: | KJXOEJKJSXCGMD-INIZCTEOSA-N |