2-(3,4-dimethylphenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
2-(3,4-dimethylphenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
Compound characteristics
| Compound ID: | 8012-1603 |
| Compound Name: | 2-(3,4-dimethylphenyl)-1,2,4-triazaspiro[4.5]decane-3-thione |
| Molecular Weight: | 275.41 |
| Molecular Formula: | C15 H21 N3 S |
| Smiles: | Cc1ccc(cc1C)N1C(NC2(CCCCC2)N1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.2433 |
| logD: | 4.2433 |
| logSw: | -4.2323 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 27.8928 |
| InChI Key: | BWHBUAVDVLTRFH-UHFFFAOYSA-N |