3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione--hydrogen chloride (1/1)
3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C200-3041 |
| Compound Name: | 3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione--hydrogen chloride (1/1) |
| Molecular Weight: | 295.83 |
| Molecular Formula: | C14 H17 N3 S |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1)C1C(NC2(CCNCC2)N=1)=S |
| Stereo: | ACHIRAL |
| logP: | 1.4336 |
| logD: | -1.9174 |
| logSw: | -1.6691 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 32.66 |
| InChI Key: | CYZUOGBZWMPFHM-UHFFFAOYSA-N |