3-[4-(2-methylpropyl)benzene-1-sulfonyl]-9-[(pyrrolidin-1-yl)methyl]-3-azaspiro[5.5]undecan-9-ol
Chemical Structure Depiction of
3-[4-(2-methylpropyl)benzene-1-sulfonyl]-9-[(pyrrolidin-1-yl)methyl]-3-azaspiro[5.5]undecan-9-ol
3-[4-(2-methylpropyl)benzene-1-sulfonyl]-9-[(pyrrolidin-1-yl)methyl]-3-azaspiro[5.5]undecan-9-ol
Compound characteristics
| Compound ID: | CM3891-0843 |
| Compound Name: | 3-[4-(2-methylpropyl)benzene-1-sulfonyl]-9-[(pyrrolidin-1-yl)methyl]-3-azaspiro[5.5]undecan-9-ol |
| Molecular Weight: | 448.67 |
| Molecular Formula: | C25 H40 N2 O3 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(N1CCC2(CCC(CC2)(CN2CCCC2)O)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2558 |
| logD: | 2.4172 |
| logSw: | -4.0205 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.542 |
| InChI Key: | HFOXJIZDYAEQBN-UHFFFAOYSA-N |