ethyl 4-{[N-(2,1,3-benzothiadiazole-4-sulfonyl)phenylalanyl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[N-(2,1,3-benzothiadiazole-4-sulfonyl)phenylalanyl]amino}piperidine-1-carboxylate
ethyl 4-{[N-(2,1,3-benzothiadiazole-4-sulfonyl)phenylalanyl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C481-1242 |
| Compound Name: | ethyl 4-{[N-(2,1,3-benzothiadiazole-4-sulfonyl)phenylalanyl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 517.63 |
| Molecular Formula: | C23 H27 N5 O5 S2 |
| Smiles: | CCOC(N1CCC(CC1)NC(C(Cc1ccccc1)NS(c1cccc2c1nsn2)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1492 |
| logD: | 3.1432 |
| logSw: | -3.3579 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.712 |
| InChI Key: | ZIWKIBAICHNEQS-IBGZPJMESA-N |