4-[2-(benzylamino)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
Chemical Structure Depiction of
4-[2-(benzylamino)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
4-[2-(benzylamino)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
Compound characteristics
| Compound ID: | S511-2058 |
| Compound Name: | 4-[2-(benzylamino)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C27 H33 N3 O5 |
| Smiles: | C1COC2(CCN(CC2)C(Nc2ccc3c(c2)OCCO3)=O)CC1CC(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3168 |
| logD: | 2.3168 |
| logSw: | -3.0367 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.332 |
| InChI Key: | YZQBYKASDHSDAV-NRFANRHFSA-N |