2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethan-1-one
Chemical Structure Depiction of
2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethan-1-one
2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | S511-2687 |
| Compound Name: | 2-[9-(methanesulfonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethan-1-one |
| Molecular Weight: | 432.58 |
| Molecular Formula: | C23 H32 N2 O4 S |
| Smiles: | CS(N1CCC2(CC1)CC(CCO2)CC(N1CCC(=CC1)c1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0481 |
| logD: | 3.0481 |
| logSw: | -3.3219 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.165 |
| InChI Key: | NNHNGZLPWVBLCJ-IBGZPJMESA-N |