N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(pyrrolidin-1-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(pyrrolidin-1-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(pyrrolidin-1-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
Compound characteristics
| Compound ID: | S431-0404 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(pyrrolidin-1-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C22 H31 N3 O4 |
| Smiles: | C1CCN(C1)C1CCOC2(CCN(CC2)C(Nc2ccc3c(c2)OCCO3)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3348 |
| logD: | -0.9094 |
| logSw: | -2.0253 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.592 |
| InChI Key: | PJVJNCRHUJDHIL-GOSISDBHSA-N |