N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-N-methylacetamide
Chemical Structure Depiction of
N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-N-methylacetamide
N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-N-methylacetamide
Compound characteristics
| Compound ID: | S511-2748 |
| Compound Name: | N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-N-methylacetamide |
| Molecular Weight: | 426.58 |
| Molecular Formula: | C20 H34 N4 O4 S |
| Smiles: | CCn1cc(CN(C)C(CC2CCOC3(CCN(CC3)S(C)(=O)=O)C2)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1696 |
| logD: | 1.1696 |
| logSw: | -1.7504 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.793 |
| InChI Key: | AOBJIECSYNLMQM-KRWDZBQOSA-N |