3-[1-(2-methoxyethyl)-1H-tetrazol-5-yl]-2-{[4-(methylsulfanyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decan-1-one
Chemical Structure Depiction of
3-[1-(2-methoxyethyl)-1H-tetrazol-5-yl]-2-{[4-(methylsulfanyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decan-1-one
3-[1-(2-methoxyethyl)-1H-tetrazol-5-yl]-2-{[4-(methylsulfanyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decan-1-one
Compound characteristics
| Compound ID: | S525-0396 |
| Compound Name: | 3-[1-(2-methoxyethyl)-1H-tetrazol-5-yl]-2-{[4-(methylsulfanyl)phenyl]methyl}-8-oxa-2-azaspiro[4.5]decan-1-one |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C20 H27 N5 O3 S |
| Smiles: | COCCn1c(C2CC3(CCOCC3)C(N2Cc2ccc(cc2)SC)=O)nnn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6995 |
| logD: | 1.6995 |
| logSw: | -2.3381 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.09 |
| InChI Key: | BXGZJKYHADOTLB-KRWDZBQOSA-N |