4-benzyl-9-(1-ethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane
Chemical Structure Depiction of
4-benzyl-9-(1-ethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane
4-benzyl-9-(1-ethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane
Compound characteristics
| Compound ID: | T500-0438 |
| Compound Name: | 4-benzyl-9-(1-ethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane |
| Molecular Weight: | 403.54 |
| Molecular Formula: | C21 H29 N3 O3 S |
| Smiles: | CCn1cc(cn1)S(N1CCC2(CC1)CC(CCO2)Cc1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2214 |
| logD: | 3.2214 |
| logSw: | -3.3124 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.782 |
| InChI Key: | NLCIKWZHMXPEBH-IBGZPJMESA-N |