(5-methylthiophen-2-yl)(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)methanone
Chemical Structure Depiction of
(5-methylthiophen-2-yl)(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)methanone
(5-methylthiophen-2-yl)(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)methanone
Compound characteristics
| Compound ID: | S726-1515 |
| Compound Name: | (5-methylthiophen-2-yl)(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)methanone |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C22 H28 N2 O3 S |
| Smiles: | Cc1ccc(C(N2CCC3(CC2)CC(CCOc2cccnc2)CCO3)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.875 |
| logD: | 3.8718 |
| logSw: | -3.6403 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.171 |
| InChI Key: | IPEXRJPYFPUMMX-GOSISDBHSA-N |