methyl N-[2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate
Chemical Structure Depiction of
methyl N-[2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate
methyl N-[2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate
Compound characteristics
| Compound ID: | S018-0546 |
| Compound Name: | methyl N-[2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate |
| Molecular Weight: | 414.54 |
| Molecular Formula: | C18 H26 N2 O5 S2 |
| Smiles: | COC(CCNC(C1CN(CC12CCCCC2)S(c1cccs1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4223 |
| logD: | 1.4223 |
| logSw: | -2.2984 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.227 |
| InChI Key: | OXIAMFTXEYUJRR-AWEZNQCLSA-N |