methyl N-[2-(pyridine-3-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate
Chemical Structure Depiction of
methyl N-[2-(pyridine-3-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate
methyl N-[2-(pyridine-3-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate
Compound characteristics
| Compound ID: | S018-0452 |
| Compound Name: | methyl N-[2-(pyridine-3-sulfonyl)-2-azaspiro[4.5]decane-4-carbonyl]-beta-alaninate |
| Molecular Weight: | 409.5 |
| Molecular Formula: | C19 H27 N3 O5 S |
| Smiles: | COC(CCNC(C1CN(CC12CCCCC2)S(c1cccnc1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6778 |
| logD: | 0.6778 |
| logSw: | -1.8476 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.726 |
| InChI Key: | MNPKJFIUDDCWPU-INIZCTEOSA-N |