8-[3-(2-methoxyethyl)-1H-1,2,4-triazol-5-yl]-6-methyl-2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-2,6-diazaspiro[3.4]octane
Chemical Structure Depiction of
8-[3-(2-methoxyethyl)-1H-1,2,4-triazol-5-yl]-6-methyl-2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-2,6-diazaspiro[3.4]octane
8-[3-(2-methoxyethyl)-1H-1,2,4-triazol-5-yl]-6-methyl-2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-2,6-diazaspiro[3.4]octane
Compound characteristics
| Compound ID: | SC55-0454 |
| Compound Name: | 8-[3-(2-methoxyethyl)-1H-1,2,4-triazol-5-yl]-6-methyl-2-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-2,6-diazaspiro[3.4]octane |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C22 H31 N5 O3 S |
| Smiles: | CN1CC(c2nc(CCOC)n[nH]2)C2(C1)CN(C2)S(c1ccc2CCCCc2c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3275 |
| logD: | -2.0088 |
| logSw: | -2.9254 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.816 |
| InChI Key: | GAYYVGSETQURGE-LJQANCHMSA-N |