ethyl 4-{1-[4-(azepane-1-sulfonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{1-[4-(azepane-1-sulfonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
ethyl 4-{1-[4-(azepane-1-sulfonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C429-0371 |
| Compound Name: | ethyl 4-{1-[4-(azepane-1-sulfonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C28 H36 N4 O5 S |
| Smiles: | CCOC(N1CCC(CC1)N1C(c2ccccc2C1=O)Nc1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5238 |
| logD: | 4.5238 |
| logSw: | -4.1382 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.046 |
| InChI Key: | MQTYUFLMIBKHNF-SANMLTNESA-N |