6-benzyl-2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane
Chemical Structure Depiction of
6-benzyl-2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane
6-benzyl-2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane
Compound characteristics
| Compound ID: | SB59-0684 |
| Compound Name: | 6-benzyl-2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane |
| Molecular Weight: | 393.55 |
| Molecular Formula: | C22 H27 N5 S |
| Smiles: | Cc1ccc(CN2CC3(CN(CC3c3nncn3C)Cc3ccccc3)C2)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6375 |
| logD: | -1.7409 |
| logSw: | -2.6135 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.793 |
| InChI Key: | MXRFENOOUGQIBF-HXUWFJFHSA-N |