6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2-(propane-1-sulfonyl)-2,6-diazaspiro[3.4]octane
Chemical Structure Depiction of
6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2-(propane-1-sulfonyl)-2,6-diazaspiro[3.4]octane
6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2-(propane-1-sulfonyl)-2,6-diazaspiro[3.4]octane
Compound characteristics
| Compound ID: | SC55-0650 |
| Compound Name: | 6-benzyl-8-(3-methyl-1H-1,2,4-triazol-5-yl)-2-(propane-1-sulfonyl)-2,6-diazaspiro[3.4]octane |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C19 H27 N5 O2 S |
| Smiles: | CCCS(N1CC2(CN(CC2c2nc(C)n[nH]2)Cc2ccccc2)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4563 |
| logD: | -2.0196 |
| logSw: | -2.2553 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.405 |
| InChI Key: | VRUVRGVMQLXMCL-QGZVFWFLSA-N |